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annotate test-data/out3.smi @ 8:a43a00845834 draft

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"planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
author bgruening
date Wed, 27 Jan 2021 18:41:45 +0000
parents 1ade252ebe08
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
rev   line source
8
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
1 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)OC(C)C)cc2)s1 CHEMBL3679770
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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2 CC(C)(O)CNC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675985
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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3 CCc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CCC(O)CC3)c2n1 CHEMBL3971680
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
4 CC1CN(C)[C@H](c2cccnc2)C1C CHEMBL334222
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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5 COCCNC(=O)c1cnn2ccc(N3CCCC3c3cc(F)cnc3C)nc12 CHEMBL3676059
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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6 Cc1cc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3OCCCO)cc2)cs1 CHEMBL3679829
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
7 O=C(c1nccs1)N1CCCC1c1ccc(-c2cccc(Cl)c2)nc1 CHEMBL1808867
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
8 CC(C)(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccco3)cc2)C1c1cccnc1OCCO CHEMBL3669815
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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9 CCCCCc1ccc(C2CCCN2C)cn1 CHEMBL103566
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
10 CC(C)(C)NC(=O)c1cnn2ccc(N3CCCC3c3cc(F)cnc3CO)nc12 CHEMBL3675955
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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11 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3OCCCO)cc2)o1 CHEMBL3679744
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
12 CN1CCCC1c1ccc(Nc2cc(-c3cc(F)cc(N4CCc5c(sc6c5CCCC6)C4=O)c3CO)cn(C)c2=O)nc1 CHEMBL3670117
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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13 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)Nc4ccc(F)cn4)c3n2)c1=O CHEMBL3676101
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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14 CCN1C(=S)N2CCCC2c2c1nc(-c1ccc(OC)cc1)c(C#N)c2N1CCOCC1 CHEMBL3589377
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
15 COCCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccoc2)cc1 CHEMBL3679826
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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16 COc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3674850
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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17 CN1CCC[C@H]1c1ccc[n+](CCCCCc2cc(CCCCC[n+]3cccc([C@@H]4CCCN4C)c3)c(CCCCC[n+]3cccc([C@@H]4CCCN4C)c3)cc2CCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1186094
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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18 O=C(c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12)N1CC(O)C1 CHEMBL3675982
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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19 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[Br-].[Br-] CHEMBL54826
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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20 c1cc2c(cn1)C1N3CCCC1(CC3)C2 CHEMBL335828
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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21 CN1CCC[C@H]1c1ccc[n+](CCCCc2ccc(CCCC[n+]3cccc([C@@H]4CCCN4C)c3)cc2)c1 CHEMBL1182422
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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22 CN1CCCC1c1ccc(O)nc1 CHEMBL72010
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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23 CO[C@H]1C[C@@H](c2cccnc2)N(C)C1 CHEMBL326597
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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24 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCCO)c2n1 CHEMBL3676026
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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25 CN1C(=O)[C@H](OC2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)C[C@H]1c1cccnc1 CHEMBL3544598
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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26 CN1CCC[C@H]1c1ccc[n+](Cc2ccccc2)c1.[Br-] CHEMBL563268
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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27 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)N3CC(O)C3)c2n1 CHEMBL3676013
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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28 C[C@@H](O)CNC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675984
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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29 CN1CCC[C@H]1c1ccc(Nc2ncc3cc(Br)c(=O)n(C4CCCC4)c3n2)nc1.Cl CHEMBL3972301
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
30 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(SC)cc1 CHEMBL3669735
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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31 CN1C(=O)CC[C@@H]1c1cccnc1 CHEMBL365343
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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32 COc1ccnc(OC)c1C1CC(C)C(=O)N1Cc1cccc(-c2ccccc2)c1 CHEMBL3897027
5
1ade252ebe08 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
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33 O=C(c1cc2c([nH]c1=O)CCC2)N1CCCC1c1cccnc1 CHEMBL3458802
8
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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34 CCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197114
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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35 CN1C(=O)CC[C@@]1(O)c1cccnc1 CHEMBL3544599
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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36 CN1[C@H](C#N)CC[C@H]1c1cccnc1 CHEMBL81899
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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37 COCc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669833
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
38 CCCCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C CHEMBL1178992
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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39 COc1ccnc(OC)c1C1CC(C)C(=O)N1Cc1cccc(-c2csc(C)n2)c1 CHEMBL3958622
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
40 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)NCC4CC4)c3n2)c1=O CHEMBL3676094
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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41 CN1CCC[C@H]1c1cccnc1 CHEMBL3
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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42 CN1C(=O)[C@@H](O)C[C@@H]1c1cccnc1 CHEMBL3126033
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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43 CN1CCCC1c1ccc(CC(O)c2ccccc2)nc1 CHEMBL363379
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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44 Cc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669789
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
45 COCCOc1ncccc1C1C(C(=O)C2CCCC2)C(=O)C(=O)N1c1ccc(-c2ccon2)cc1 CHEMBL3679786
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
46 COc1cc(-c2ccc3ncc(C(=O)C4CC4)c(Nc4ccc(C5CCCN5C)cn4)c3c2)cc(Cl)c1O CHEMBL3674295
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
47 C[C@@H](CO)NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675990
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
48 CCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL3614075
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
49 O=C(N[C@@H]1C2CC[C@@H](C2)[C@@H]1CO)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3676012
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
50 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCC[n+]2cccc([C@H]3CCCN3C)c2)c1.[Br-].[Br-] CHEMBL551930
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
51 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2cccs2)nc1 CHEMBL3669770
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
52 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1ccccn1 CHEMBL1808878
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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53 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)N3CCCC3)cc2)s1 CHEMBL3679838
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
54 CN1CCC[C@H]1c1ccc[n+](C)c1.[I-] CHEMBL541771
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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55 Cc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC(C)C)c2n1 CHEMBL3676052
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
56 CCCCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1179038
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
57 CCCCCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C CHEMBL1183493
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
58 CN1C(=S)CC[C@H]1c1cccnc1 CHEMBL3114543
5
1ade252ebe08 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
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diff changeset
59 CCCc1cc(C(=O)N2CCCC2c2cccnc2)[nH]n1 CHEMBL3486295
8
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
60 CN1CCC[C@H]1c1ccc[n+](CCCCCCNCC2CCc3ccc(O)cc3O2)c1 CHEMBL3614072
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
61 CN1CCC[C@H]1c1ccc[n+](CCCCCc2cc(CCCCC[n+]3cccc([C@@H]4CCCN4C)c3)cc(CCCCC[n+]3cccc([C@@H]4CCCN4C)c3)c2)c1.[Br-].[Br-].[Br-] CHEMBL241119
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
62 CN1C(=O)CC[C@@H]1c1ccc[n+]([O-])c1 CHEMBL3126028
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
63 CCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C.[I-] CHEMBL301648
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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64 c1cc2c(cn1)[C@@H]1N3CCC1(CC3)C2 CHEMBL2111859
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
65 C=CC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1196878
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
66 CN1CCC[C@H]1c1ccc[n+](CCCCCNCC2CCc3ccc(O)cc3O2)c1 CHEMBL3614081
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
67 CC(NC(=O)c1cnn2ccc(N3C(c4cncc(F)c4)CCC3(C)CO)nc12)C(F)(F)F CHEMBL3676085
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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68 CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CC(C)(C)C[C@@H]2c2cccnc2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2NC(=O)O[C@]12C CHEMBL2338710
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
69 O=C(NC1CC1)c1cnn2ccc(N3CCCC3c3cc(F)cnc3CO)nc12 CHEMBL3675954
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
70 COC(=O)N1CC[C@@H]2C[C@@H](Sc3ccccc3)c3cc(Cl)nc(Cl)c3[C@@H]21 CHEMBL225181
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
71 CN1CCC[C@H]1c1ccc[n+](CCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[I-].[I-] CHEMBL104461
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
72 CCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1194306
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
73 COCCOc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(SC)cc1 CHEMBL3679811
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
74 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)Nc3ccn(C)n3)c2n1 CHEMBL3676103
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
75 CCOc1ccc(N2C(=O)C3=NCCNC(c4ccc(Cl)cc4)=C3C2c2cccnc2)cc1 CHEMBL1325781
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
76 COCCOCc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669811
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
77 C#Cc1cncc(C2CCCN2C)c1 CHEMBL111580
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
78 CNC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cnc3OC)nc12 CHEMBL3676024
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
79 CC(C)(C)NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)c[nH]c3=O)nc12 CHEMBL3676069
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
80 O=C(c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CCC1 CHEMBL3676000
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
81 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)NCCN(C)C)cc2)s1 CHEMBL3679841
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
82 CCOc1ncccc1C1C(C(=O)C2CCCC2)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3679781
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
83 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1ccncc1 CHEMBL1808880
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
84 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC[C@H](O)CO)c2n1 CHEMBL3676017
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
85 CN1C(=O)CCC1c1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1 CHEMBL3925012
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
86 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)NC(C)(C)C)c3n2)c1=O CHEMBL3676088
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
87 COCC(O)CNC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675993
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
88 O=C(NC1CCC1)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675975
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
89 CN1CCC[C@H]1c1ccc[n+](Cc2ccccc2)c1 CHEMBL1197228
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
90 CC(C)(C)NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675930
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
91 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[Br-].[Br-] CHEMBL420649
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
92 CCOC(=O)c1c(C)nc2c(C3CCCN3C)cccn12 CHEMBL2147747
5
1ade252ebe08 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
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parents: 3
diff changeset
93 CN1CCC[C@H]1c1cccnc1.C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C CHEMBL3114541
8
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
94 CN1CCCC1c1cnccc1N CHEMBL193763
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
95 CC[C@H]1C[C@@H](c2cccnc2)N(C)C1 CHEMBL115793
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
96 CCCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21.[I-] CHEMBL441977
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
97 CCCCC#CCCCCCC[n+]1cccc(C2CCCN2C)c1.[Br-] CHEMBL599540
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
98 O=CN1CCC[C@H]1c1cccnc1 CHEMBL3126024
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
99 CN1C[C@H](CO)C[C@H]1c1cccnc1 CHEMBL434607
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
100 CN1C(=O)C[C@H](C(=O)O)[C@@H]1c1cccnc1 CHEMBL1715972
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
101 O=C1CC[C@]2(c3cccnc3)O[C@H](COc3ccc(Cl)cc3)CN12 CHEMBL343159
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
102 C=CS(=O)(=O)[C@H]1C[C@]2(C(=O)OC)CCC(=O)N2[C@H]1c1cccnc1 CHEMBL493120
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
103 Cc1cc(N(C)C)nc(N2CCCC2c2cccnc2)n1 CHEMBL3454403
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
104 CN1C(=O)CC[C@H]1c1cccnc1.CN1C(=O)CC[C@H]1c1cccnc1.O=C(O)/C=C/C(=O)O CHEMBL3989573
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
105 O=C(NC1CC1)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675929
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
106 COCCOc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2cccs2)cc1 CHEMBL3669795
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
107 CONC(=O)c1cnn2ccc(N3CCCC3c3cc(F)cnc3CO)nc12 CHEMBL3675958
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
108 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCCCCO)c2n1 CHEMBL3676022
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
109 CN1C[C@@H](CO)C[C@H]1c1cccnc1 CHEMBL118849
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
110 CC(C)(O)Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1nccs1 CHEMBL1808887
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
111 CN1CCCC1c1cccnc1 CHEMBL440464
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
112 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)NN(C)C)cc2)s1 CHEMBL3679835
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
113 CCCC/C=C/CC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197208
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
114 CN1C(=O)CC[C@H]1c1ccc[n+](C)c1 CHEMBL3544791
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
115 O=C(NC1CCC[C@@H]1O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675994
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
116 COc1ccc(CCc2ccc(C3CCCN3C)cn2)cc1 CHEMBL190652
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
117 CN1CCC[C@H]1c1ccc[n+](C)c1 CHEMBL1190855
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
118 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)N[C@@H]3CCC[C@H]3O)c2n1 CHEMBL3676064
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
119 CCCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C.[I-] CHEMBL57108
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
120 C=CCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197169
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
121 CCc1cc(NC(=O)c2cnn3ccc(N4CCCC4c4cc(F)cnc4OC)nc23)[nH]n1 CHEMBL3676105
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
122 CCCCCCCCCC[n+]1cccc2c1CC[C@]1(C)CCN(C)[C@]21C.[I-] CHEMBL320633
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
123 CN1CCC[C@H]1c1ccc[n+](CCCCCc2cc(CCCCC[n+]3cccc([C@@H]4CCCN4C)c3)cc(CCCCC[n+]3cccc([C@@H]4CCCN4C)c3)c2)c1 CHEMBL1182507
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
124 CCCCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21.[I-] CHEMBL441186
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
125 CCCCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21 CHEMBL1185915
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
126 CN1CCC[C@H]1c1cccnc1.O=C(O)C(O)C(O)C(=O)O.O=C(O)C(O)C(O)C(=O)O CHEMBL151515
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
127 OC(COc1ccccc1-c1nc2ccccc2o1)CN1CCCC1c1cccnc1 CHEMBL608832
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
128 CN1C[C@@H](Cc2ccccc2)C[C@H]1c1cccnc1 CHEMBL420694
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
129 Cc1nc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3OCCO)cc2)no1 CHEMBL3669818
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
130 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1OCCCO CHEMBL3679823
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
131 O=C1NC(=O)/C(=C/c2cnn3c(NC4CC4)nc(N4CCCC4c4cccnc4)nc23)N1 CHEMBL3984229
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
132 NCCCNC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)c[nH]c3=O)nc12 CHEMBL3676016
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
133 CN1CCCC1c1ccc(Nc2c(C(=O)C3CC3)cnc3ccc(-c4cc(Cl)c(O)c(Cl)c4)cc23)nc1 CHEMBL3674296
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
134 Cc1cc(-c2cc(C)c(C3CCCN3C(=O)c3cnccn3)cn2)ccn1 CHEMBL1808895
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
135 CCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21.[I-] CHEMBL417925
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
136 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1cccnc1 CHEMBL1808879
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
137 CC1=C[C@H]2Cc3[nH]c(=O)ccc3[C@@]3(C1)[C@@H]2[C@H](C)CN3C CHEMBL2409141
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
138 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2cccs2)cc1 CHEMBL3639736
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
139 CN1CCCC1c1ccc(-c2ccccc2)nc1 CHEMBL350748
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
140 COc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)Nc3cc(C)n[nH]3)c2n1 CHEMBL3676102
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
141 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1Cl CHEMBL3674784
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
142 CN1CCCC1c1cncc(Br)c1 CHEMBL61772
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
143 O=C(Nc1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CC[C@@H](O)C1 CHEMBL4108902
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
144 O=C(N[C@H]1CC[C@H](O)C1)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675979
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
145 CN1CCC[C@H]1c1cccnc1.O.O.O=C(O)C(O)C(O)C(=O)O.O=C(O)C(O)C(O)C(=O)O CHEMBL3989563
5
1ade252ebe08 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
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parents: 3
diff changeset
146 CC1=C(C(=O)N2CCCC2c2cccnc2)C(c2ccc(Cl)c(Cl)c2)n2nccc2N1 CHEMBL601248
8
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
147 CN1CCC[C@H]1c1cccnc1.C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O CHEMBL3114538
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
148 CN1[C@H](c2cccnc2)CC[C@@H]1c1ccccc1 CHEMBL443018
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
149 CN1CCC[C@H]1c1ccc[n+](CCCCCCNCC2CCc3ccc(O)cc3O2)c1.[Br-] CHEMBL3612359
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
150 Cc1ccc(NC(=O)c2cnn3ccc(N4CCC[C@@H]4c4cc(F)cn(C)c4=O)nc23)cn1 CHEMBL3676091
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
151 CCCCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C.[I-] CHEMBL52983
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
152 Cc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccco2)cc1 CHEMBL3669788
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
153 Cc1cc(-c2cc(F)cc(Cl)c2)ncc1C1CCCN1C(=O)c1cnccn1 CHEMBL1808893
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
154 CNC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cnc3C)nc12 CHEMBL3676054
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
155 CN1CCC[C@H]1c1ccc[n+](CCCC#Cc2cc(C#CCCC[n+]3cccc([C@@H]4CCCN4C)c3)c(C#CCCC[n+]3cccc([C@@H]4CCCN4C)c3)cc2C#CCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[Br-].[Br-].[Br-].[Br-] CHEMBL2368590
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
156 CN1[C@H](c2cccnc2)CC[C@@H]1C#N CHEMBL84210
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
157 COCCNC(=O)[C@H]1C[C@@](CC(C)C)(C(=O)O)N(C)[C@H]1c1cccnc1 CHEMBL3475838
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
158 COc1ncc(-c2ccc(C(=O)O)cc2C)cc1-c1ncc(C(F)(F)F)cc1[C@@H]1CC[C@H]2[C@@H](c3cc(C(F)(F)F)cc(C(F)(F)F)c3)OC(=O)N12 CHEMBL3657536
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
159 CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCC[C@@H]2c2cccnc2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2NC(=O)O[C@]12C CHEMBL2338711
5
1ade252ebe08 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
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parents: 3
diff changeset
160 NC(=O)c1ccc(Oc2ccc(CN3CCCC3c3cccnc3)cc2)nc1 CHEMBL1921840
8
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
161 CN1CCC[C@]12CCc1ccncc12 CHEMBL2112670
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
162 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3OCCO)cc2)o1 CHEMBL3679749
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
163 CN1CCC[C@@H]1c1ccc(Nc2cc(-c3cc(F)cc(N4CCn5c(cc6c5CC(C)(C)C6)C4=O)c3CO)cn(C)c2=O)nc1 CHEMBL3670119
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
164 COc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674810
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
165 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)Nc3cc(C4CC4)n[nH]3)c2n1 CHEMBL3676104
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
166 CC(C)(CO)CNC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675999
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
167 CN/C(=C1\C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1ccc[nH]c1=O)C(C)C CHEMBL3674777
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
168 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)nc1 CHEMBL3669759
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
169 CN1CCCC1c1ccc(Nc2c(C(=O)C3CC3)cnc3ccc(-c4cc(F)c(O)c(Cl)c4)cc23)nc1 CHEMBL3674294
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
170 COCCOc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669785
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
171 COc1ccnc(OC)c1C1CC(C)C(=O)N1Cc1cccc(-c2ncc(C)s2)c1 CHEMBL3986272
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
172 CNC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675988
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
173 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)NC4CCC4)c3n2)c1=O CHEMBL3676092
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
174 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2cccs2)cc1 CHEMBL3669764
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
175 CC(C)NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cn(C)c3=O)nc12 CHEMBL3676089
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
176 O=S(=O)(Nc1ncns1)c1ccc2c(N3CCC[C@H]3c3cccnc3)cccc2c1 CHEMBL3692144
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
177 CN1CCC[C@H]1c1ccc[n+](CCCCc2ccc(CCCC[n+]3cccc([C@@H]4CCCN4C)c3)cc2)c1.[Br-].[Br-] CHEMBL238117
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
178 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3OC(C)C)cc2)o1 CHEMBL3679745
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
179 COc1ccc(CN2C(=O)CCC2c2cccnc2)cc1 CHEMBL3126032
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
180 COc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3674853
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
181 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1cncnc1 CHEMBL1808877
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
182 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccoc2)cc1 CHEMBL3674761
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
183 CCN1C(=S)N2CCCC2c2c1nc(-c1ccc(OC)c(O)c1)c(C#N)c2N1CCOCC1 CHEMBL3589378
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
184 CCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.I.[I-] CHEMBL1322435
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
185 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)N(C)C)cc2)s1 CHEMBL3679833
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
186 NC(=O)c1ccc(Oc2ccc(CN3CCCC3c3cccnc3)cc2)c(Cl)c1 CHEMBL1921841
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
187 C[N@@+]1(CC[N@@+]2(C)CCC[C@H]2c2cccnc2)CCC[C@@H]1c1cccnc1 CHEMBL1358826
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
188 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC(CO)CO)c2n1 CHEMBL3676031
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
189 CN1C(=O)CC[C@H]1c1ccc[n+]([O-])c1 CHEMBL3544793
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
190 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)NCC#N)cc2)s1 CHEMBL3679836
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
191 CCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674944
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
192 CN1CCC(CF)[C@H]1c1cccnc1 CHEMBL119016
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
193 CCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL560190
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
194 CN1CC[C@@H]2CCc3ccncc3[C@@H]21 CHEMBL417278
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
195 CN1CCC[C@H]1c1ccc[n+]([O-])c1 CHEMBL3126025
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
196 CCCCCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C.[I-] CHEMBL300598
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
197 CN1CCC[C@H]1c1cccnc1.Cl CHEMBL225057
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
198 COc1cncc(C2CCCN2C)c1 CHEMBL303530
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
199 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1179942
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
200 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC[C@H](C)O)c2n1 CHEMBL3676027
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
201 CN1CCCC1c1ccc(/C=C/c2ccccc2)nc1 CHEMBL190678
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
202 CN1CCC[C@@H]1c1cccnc1.O=C(O)C(O)C(O)C(=O)O.O=C(O)C(O)C(O)C(=O)O CHEMBL2062338
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
203 C=CCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197178
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
204 CN1CCC[C@H]1c1ccc[n+](CCCC#Cc2cc(C#CCCC[n+]3cccc([C@@H]4CCCN4C)c3)cc(C#CCCC[n+]3cccc([C@@H]4CCCN4C)c3)c2)c1.[Br-].[Br-].[Br-] CHEMBL437574
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
205 CCNC(=O)c1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679793
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
206 CN1CCC[C@H]1c1ccc(Nc2ncc3cc(Br)c(=O)n(C4CCCC4)c3n2)nc1 CHEMBL3990288
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
207 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2noc(C)n2)cc1 CHEMBL3669816
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
208 CCCCCCCCCC[n+]1cccc2c1CC[C@]1(C)CCN(C)[C@]21C CHEMBL1183842
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
209 O=C(C(Nc1ccccc1F)c1cc2ccccc2s1)N1CCCC1c1cccnc1 CHEMBL2348659
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
210 Cc1ccc2nc(CN3CCCC3c3cccnc3)cc(O)c2c1 CHEMBL3485916
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
211 C#Cc1cncc([C@H]2CCCN2C)c1 CHEMBL1788226
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
212 COCCOc1ncccc1C1C(C(=O)CC(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674965
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
213 Cc1cc(-c2cc(C)c(C3CCCN3C(=O)c3cncs3)cn2)ccn1 CHEMBL1808894
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
214 C[N+]1(CC[N+]2(C)CCCC2c2cccnc2)CCCC1c1cccnc1 CHEMBL1978965
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
215 CC(C)C[C@H](N[C@H](CCN1C(=O)c2cc3ccccc3cc2C1=O)C(=O)O)C(=O)N1CCCC1c1cccnc1 CHEMBL158622
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
216 CC(C)(CO)NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676006
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
217 COc1ccnc(OC)c1C1CC(C)C(=O)N1Cc1cccc(-c2nc(Cl)cs2)c1 CHEMBL3943155
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
218 O=C(Nc1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CC[C@H](O)C1 CHEMBL3944177
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
219 CC(C)[C@H](CO)NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675996
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
220 O=C(Nc1ccccc1F)N1CCCC1c1cccnc1 CHEMBL1870182
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
221 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCC[n+]2cccc([C@H]3CCCN3C)c2)c1 CHEMBL1194341
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
222 CC(C)[C@@H](CO)NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675995
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
223 O=C(N[C@@H]1CCC[C@H]1O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676007
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
224 CN1C[C@H](C#N)C[C@H]1c1cccnc1 CHEMBL119352
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
225 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1nccs1 CHEMBL1808872
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
226 C[C@H](NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12)C(F)(F)F CHEMBL3676004
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
227 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCCNCC2CCc3ccc(O)cc3O2)c1 CHEMBL3614077
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
228 CC(C)(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1OCCO CHEMBL3669809
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
229 CN1C(=O)CC[C@H]1c1cccnc1 CHEMBL578211
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
230 C#Cc1cncc([C@@H]2CCCN2C)c1 CHEMBL111659
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
231 CN1CCC[C@H]1c1ccc[n+](CCCC#Cc2ccccc2C#CCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1182432
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
232 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)o2)cc1 CHEMBL3674872
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
233 C[C@H](CO)NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675989
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
234 CN1CCC[C@H]1c1ccc[n+](CCCC#Cc2ccccc2C#CCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[Br-].[Br-] CHEMBL238769
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
235 CCCC[C@@H]1CC[C@@H](c2cccnc2)N1C CHEMBL119574
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
236 CCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL550723
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
237 CCCCC#CCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL559109
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
238 O=C(c1ccc(F)c(F)c1)N1CCN2C(=O)c3ccccc3[C@@]12c1ccc(N2CCC[C@H]2c2cccnc2)cc1 CHEMBL4100810
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
239 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)C1CCS(=O)(=O)C1 CHEMBL1808882
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
240 CN1C[C@@H](CC#N)C[C@H]1c1cccnc1 CHEMBL334001
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
241 COc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccoc2)cc1 CHEMBL3674856
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
242 CSc1ccc(N2C(=O)C(=O)C(C(=O)C(C)(C)C)C2c2cccnc2OCCO)cc1 CHEMBL3669813
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
243 CCN(C)C(=O)c1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679834
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
244 CN1C(=O)C(C(=O)O)C[C@@H]1c1cccnc1 CHEMBL3126035
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
245 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCC(C)(C)O)c2n1 CHEMBL3676029
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
246 CC(NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12)C1CC1 CHEMBL3675987
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
247 CN1CCC[C@H]1c1ccc[n+](CCCC#Cc2cc(C#CCCC[n+]3cccc([C@@H]4CCCN4C)c3)cc(C#CCCC[n+]3cccc([C@@H]4CCCN4C)c3)c2)c1 CHEMBL1185865
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
248 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1N1CCOCC1 CHEMBL3679789
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
249 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)N[C@@H]4CCCC[C@H]4O)c3n2)c1=O CHEMBL3676096
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
250 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1179025
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
251 COCCOc1ncccc1[C@@H]1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679738
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
252 COCc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669806
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
253 COc1ccc(-c2c(C)cc(C(=O)O)cc2C)cc1-c1ncc(C(F)(F)F)cc1[C@@H]1CC[C@H]2[C@@H](c3cc(C(F)(F)F)cc(C(F)(F)F)c3)OC(=O)N12 CHEMBL3657535
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
254 CC(=O)O[C@H]1C[C@@H](c2cccnc2)N(C)C1 CHEMBL419230
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
255 Cc1cc(N2CCCC2c2cccnc2)nc(C)n1 CHEMBL3454373
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
256 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)NC4(C)CC4)c3n2)c1=O CHEMBL3676099
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
257 NC(=O)c1ccc(Oc2ccc(CN3CCCC3c3cccnc3)cc2)c2ccccc12 CHEMBL4095563
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
258 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)Nc4cccnc4)c3n2)c1=O CHEMBL3676093
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
259 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1OCC(N)=O CHEMBL3669838
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
260 O=C1[C@@H](NS(=O)(=O)c2ccc3cc(Cl)ccc3c2)CCCN1CC(=O)N1CCCC1c1cccnc1 CHEMBL1923459
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
261 Cc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC(C)(C)C)c2n1 CHEMBL3676051
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
262 CN1CCCC1c1ccc(Cl)nc1 CHEMBL70050
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
263 CN1CC[C@@H]2CCc3cc[n+]([BH2-]C#N)cc3[C@@H]21 CHEMBL21553
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
264 Cc1cc(-c2cccc(Cl)c2)ncc1C1CC(F)CN1C(=O)C1CCC1 CHEMBL1808900
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
265 COC[C@H]1C[C@@H](c2cccnc2)N(C)C1 CHEMBL119227
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
266 Cc1nc2ccccc2n1Cc1ccc(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2CCCC2c2cccnc2)s1 CHEMBL1779603
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
267 CN1C(=O)[C@@H](C(N)=O)C[C@@H]1c1cccnc1 CHEMBL3126036
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
268 CCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C CHEMBL1178973
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
269 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccoc2)cc1 CHEMBL3669767
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
270 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CCC(O)CC3)c2n1 CHEMBL3904952
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
271 COC(=O)N1CC[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)c3cc(Cl)nc(Cl)c3[C@@H]21 CHEMBL224667
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
272 COc1ccncc1C1CCCN1C CHEMBL370168
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
273 CCCc1cncc(C2CCCN2C)c1 CHEMBL382287
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
274 CN1CCCC1c1cccnc1.O=S(=O)(O)O CHEMBL2142095
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
275 CCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL559757
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
276 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1183837
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
277 COCCOc1ncccc1C1C(C(=O)C2CCCC2)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3679783
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
278 CCCC[C@H]1CC[C@@H](c2cccnc2)N1C CHEMBL119581
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
279 CC1(NC(=O)c2cnn3ccc(N4CCCC4c4cncc(F)c4)nc23)CCC1 CHEMBL3675976
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
280 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)NC(C)C)cc2)s1 CHEMBL3679837
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
281 COc1ncc(-c2c(C)cc(C(=O)O)cc2C)cc1-c1ncc(C(F)(F)F)cc1[C@@H]1CC[C@H]2[C@@H](c3cc(C(F)(F)F)cc(C(F)(F)F)c3)OC(=O)N12 CHEMBL3657533
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
282 O=C(Nc1ccccc1C(F)(F)F)N1CCCC1c1cccnc1 CHEMBL1353542
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
283 CN1CCC[C@H]1c1ccc[n+](CCCC#Cc2cccc(C#CCCC[n+]3cccc([C@@H]4CCCN4C)c3)c2)c1.[Br-].[Br-] CHEMBL391220
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
284 CC(C)(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)C1c1cccnc1OCCO CHEMBL3669808
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
285 CN1CCC[C@H]1c1ccc[n+](CCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[I-].[I-] CHEMBL105440
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
286 CCN1C(=S)N2CCCC2c2c1nc(-c1cccc(O)c1)c(C#N)c2N1CCOCC1 CHEMBL3589375
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
287 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCC(O)CO)c2n1 CHEMBL3676020
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
288 CCN(C)C(=O)[C@H]1C[C@@](CC(C)C)(C(=O)OC)N(C)[C@H]1c1cccnc1 CHEMBL3475081
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
289 COCCOc1ncccc1[C@H]1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674936
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
290 Cc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCCO)c2n1 CHEMBL3676056
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
291 CN1CCCC1c1ccc(F)nc1 CHEMBL72470
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
292 COCCOc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccoc2)cc1 CHEMBL3669807
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
293 CC(C)NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675968
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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diff changeset
294 CN1CCC[C@@]1(O)c1cccnc1 CHEMBL3544720
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
295 CN1CCCC1c1ccc(CCCc2ccccc2)nc1 CHEMBL361703
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
296 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1cncs1 CHEMBL1808873
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
297 CCN1C(=S)N2CCCC2c2c1nc(-c1ccc(OC)c(OC)c1)c(C#N)c2N1CCOCC1 CHEMBL3589379
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
298 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)NC3CCC3)c2n1 CHEMBL3676053
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
299 CCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21 CHEMBL1179016
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
300 CN1CCC[C@H]1c1ccc[n+](CCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1179917
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
301 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)NC3(CO)CC3)c2n1 CHEMBL3676061
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
302 Cc1ncccc1C1CCCN1C CHEMBL160034
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
303 COCC(C)NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675992
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
304 c1cncc(C2CCCN2C2c3ccccc3Oc3ccccc32)c1 CHEMBL278775
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
305 CCCc1nn(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)Nc4ncccc4C4CCCN4C)ccc3OCC)nc12 CHEMBL2047881
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
306 CCc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CC3)c2n1 CHEMBL3676050
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
307 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)C1c1cccnc1OCCO CHEMBL3674760
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
308 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)N3CC(C)(O)C3)c2n1 CHEMBL3676018
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
309 C=CC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL558518
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
310 CC1(O)CN(C(=O)c2cnn3ccc(N4CCC[C@@H]4c4cncc(F)c4)nc23)C1 CHEMBL3675967
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
311 CCCCC#CCCCCCC[n+]1cccc(C2CCCN2C)c1 CHEMBL1198250
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
312 COC(=O)COCc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669821
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
313 CN1CCCC1c1ccc(CCc2ccc(Cl)cc2)nc1 CHEMBL189470
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
314 COc1ncccc1C1C(C(=O)CC(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674964
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
315 CCCCCOc1ccc(C[C@H](NC(=O)C2CC(=O)N(C)C2c2cccnc2)C(=O)O)cc1 CHEMBL352062
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
316 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[I-].[I-] CHEMBL320514
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
317 Cc1nc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3N3CCOCC3)cc2)no1 CHEMBL3679788
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
318 Cc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC[C@@H](C)O)c2n1 CHEMBL3676057
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
319 O=C1CC[C@]2(c3cccnc3)O[C@@H](COc3ccc(Cl)cc3)CN12 CHEMBL442410
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
320 COC(=O)N1CC[C@@H]2CCc3ccnc(Cl)c3[C@@H]21 CHEMBL374612
5
1ade252ebe08 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
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parents: 3
diff changeset
321 Cc1ccc(-c2cc(C(=O)N3CCCC3c3cccnc3)[nH]n2)o1 CHEMBL3485246
8
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
322 C=CCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL563663
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
323 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)NC4CC4)c3n2)c1=O CHEMBL3676090
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
324 C[C@@H](NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cn(C)c3=O)nc12)C1CC1 CHEMBL3676097
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
325 O=C(c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CC(CO)C1 CHEMBL3676001
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
326 Cc1cc(-c2cccc(Cl)c2)ncc1C1CC(F)CN1C(=O)c1cncs1 CHEMBL1808899
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
327 CN1CCC[C@H]1c1ccc[n+]([BH2-]C#N)c1 CHEMBL282473
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
328 C=CCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL561470
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
329 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCNCC2CCc3ccc(O)cc3O2)c1.[Br-] CHEMBL3612360
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
330 CN1CCCC1c1cncc(C2CCCN2C)c1 CHEMBL3593860
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
331 c1cc2c(cn1)[C@H]1CCCN1CC2 CHEMBL3578315
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
332 O=C(NCCO)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675986
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
333 COCCNC(=O)c1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679839
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
334 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC[C@@H](C)O)c2n1 CHEMBL3676028
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
335 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2csc(C)c2)cc1 CHEMBL3674792
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
336 COc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669826
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
337 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1ccncn1 CHEMBL1808876
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
338 CCCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C CHEMBL1179053
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
339 CSC[C@H]1C[C@@H](c2cccnc2)N(C)C1 CHEMBL119144
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
340 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NOCCOC(C)(C)C)c2n1 CHEMBL3676023
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
341 CN1CCCC1c1ccc(C(=O)O)nc1 CHEMBL370709
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
342 O=C(NCC1CC1)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675980
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
343 C[C@@H](NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)C1CC1 CHEMBL3675997
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
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parents: 5
diff changeset
344 CCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL538685
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
345 O=C(NOCCO)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cnc3Cl)nc12 CHEMBL3676087
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
346 CN1C(=O)CCC1c1cccnc1 CHEMBL664
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
347 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC[C@@H](O)CO)c2n1 CHEMBL3676021
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
348 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(N)=O)cc2)s1 CHEMBL3679831
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
349 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)NC3CCC(O)CC3)c2n1 CHEMBL3955007
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
350 Cc1cc(C(=O)N2CCCC2c2ccc(-c3cccc(Cl)c3)nc2)no1 CHEMBL1808869
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
351 COCCOc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674772
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
352 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)N[C@H]3CC[C@H](O)C3)c2n1 CHEMBL3676063
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
353 CC(C)NC(=O)c1cnn2ccc(N3[C@H](CO)CC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676080
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
354 CC(C)(CF)NC(=O)c1cnn2ccc(N3CCCC3c3cc(F)cnc3CO)nc12 CHEMBL3675956
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
355 CN1CCCC1c1ccc[n+](CCCc2ccc(-c3ccc(CCC[n+]4cccc(C5CCCN5C)c4)cc3)cc2)c1 CHEMBL1197966
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
356 O=C(NCC(F)CCl)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675972
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
357 C[C@H]1CC[C@@H](c2cccnc2)N1C CHEMBL116645
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
358 COCCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679828
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
359 CN1CCCC1c1ccc(Nc2cc(-c3cc(F)cc(N4CCc5c(sc6c5CC(C)(C)C6)C4=O)c3CO)cn(C)c2=O)nc1 CHEMBL3670116
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
360 O=C(C1CCC1)N1CCCC1c1ccc(-c2cccc(Cl)c2)nc1 CHEMBL1808871
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
361 COc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2csc(C)c2)cc1 CHEMBL3674886
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
362 CCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C CHEMBL1183508
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
363 COCc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674842
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
364 CN1CCCC1c1ccc(N)nc1 CHEMBL70774
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
365 CCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1179042
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
366 O=C(NC1CCOCC1)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675947
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
367 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)Nc3ccn(C(C)C)n3)c2n1 CHEMBL3676106
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
368 O=C(c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CC[C@H](O)C1 CHEMBL3676002
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
369 CCNC(=O)c1cc2c(N3CCCC3c3cccnc3)ccnc2[nH]1 CHEMBL4064004
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
370 CCN1CCCC1c1cccnc1 CHEMBL163042
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
371 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)Nc3ccc(=O)[nH]c3)c2n1 CHEMBL3676032
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
372 COc1ccc(C2CCCN2C)cn1 CHEMBL292114
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
373 CCCCc1ccc(C2CCCN2C)cn1 CHEMBL320023
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
374 O=S(=O)(Nc1ncns1)c1ccc2c(N3CCCC3c3cccnc3)cccc2c1 CHEMBL3682681
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
375 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)NC3(C)CC3)c2n1 CHEMBL3676058
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
376 CCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197124
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
377 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)C1CCC1 CHEMBL1808881
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
378 Cc1cc(-c2cc(F)cc(Cl)c2)ncc1C1CCCN1C(=O)c1cncs1 CHEMBL1808892
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
379 CN1CCCC1c1ccc(CCc2ccccc2)nc1 CHEMBL190295
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
380 C=CCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197241
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
381 O=C1CC[C@@H](c2cccnc2)N1CO CHEMBL3544621
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
382 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(N)=O)c2n1 CHEMBL3676055
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
383 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CCN(S(C)(=O)=O)CC3)c2n1 CHEMBL3676033
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
384 CN1CCCC1c1ccc(Br)nc1 CHEMBL58231
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
385 c1cc2c(cn1)[C@H]1N3CCC1(CC3)C2 CHEMBL2112676
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
386 CCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1196877
5
1ade252ebe08 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
bgruening
parents: 3
diff changeset
387 NC(=O)c1ccc(Oc2ccc(CN3CCC[C@@H]3c3cccnc3)cc2)c(Cl)c1 CHEMBL1921843
8
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
388 CS(=O)(=O)N1CCC(NC(=O)c2cnn3ccc(N4CCCC4c4cncc(F)c4)nc23)CC1 CHEMBL3675945
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
389 CCc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)NCC(C)(C)O)c2n1 CHEMBL3676068
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
390 O=S(=O)(Nc1ncns1)c1ccc2c(N3CCC[C@@H]3c3cccnc3)cccc2c1 CHEMBL3682682
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
391 C[C@@H]1CC[C@@H](c2cccnc2)N1C CHEMBL118038
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
392 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)N[C@H](CO)C(C)(C)C)c3n2)c1=O CHEMBL3676095
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
393 C[C@H](NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)C1CC1 CHEMBL3675998
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
394 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)N[C@H]3CN4CCC3CC4)c2n1 CHEMBL3676065
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
395 Cc1cc(-c2cc(F)cc(F)c2)ncc1C1CCCN1C(=O)c1cncs1 CHEMBL1808890
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
396 c1cncc(C2CCCN2c2ccnc3[nH]ncc23)c1 CHEMBL4066892
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
397 O=C(NC1CCN(Cc2ccn(-c3ccc(C(F)(F)F)cc3)c2)CC1)N1CCCC1c1cccnc1 CHEMBL560283
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
398 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669812
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
399 CN1CCC[C@H]1c1ccc[n+](CCCC#Cc2cccc(C#CCCC[n+]3cccc([C@@H]4CCCN4C)c3)c2)c1 CHEMBL1185135
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
400 O=C(C1CCC1)N1CCCC1c1cnc(-c2cccc(Cl)c2)cc1O CHEMBL1808886
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
401 Cc1cc(C)nc(N2CCCC2c2cccnc2)n1 CHEMBL3436596
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
402 c1cc2c(cn1)[C@@H]1CCCN1CC2 CHEMBL3578316
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
403 CN1CCC[C@H]1c1cccnc1.C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@@]21C CHEMBL3114539
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
404 c1ccc(CN2CCCC2c2cccnc2)cc1 CHEMBL163552
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
405 Cc1cc(-c2cc(F)cc(F)c2)ncc1C1CCCN1C(=O)c1cnccn1 CHEMBL1808891
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
406 CC(NC(=O)c1cnn2ccc(N3C(CO)CCC3c3cncc(F)c3)nc12)C(F)(F)F CHEMBL3676078
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
407 COCCOc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccon2)cc1 CHEMBL3669786
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
408 CNC(=O)COc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669837
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
409 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3674791
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
410 CC1(NC(=O)c2cnn3ccc(N4CCC[C@@H]4c4cncc(F)c4)nc23)CC1 CHEMBL3675966
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
411 CN1CCC(CO)[C@H]1c1cccnc1 CHEMBL325426
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
412 CCCCC/C=C/CCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197030
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
413 CN1CCC[C@@H]1c1cccnc1 CHEMBL9732
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
414 CC(=O)[C@H]1OC([n+]2cccc([C@@H]3CCC(=O)N3C)c2)[C@H](O)[C@@H](O)[C@@H]1O CHEMBL3559662
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
415 O=C(c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CCCC1 CHEMBL3675969
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
416 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3OCCCO)cc2)s1 CHEMBL3679827
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
417 CCOc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674943
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
418 C[C@H](O)CNC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675983
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
419 C[C@@H](NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12)C(F)(F)F CHEMBL3676003
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
420 O=C(NCC(F)(F)F)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676005
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
421 CN1C(=S)CC[C@H]1c1cccnc1.C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@@]21C CHEMBL3114536
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
422 c1cc2c(cn1)C1CCCN1CC2 CHEMBL3578314
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
423 CN1C[C@@H](CF)C[C@H]1c1cccnc1 CHEMBL116706
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
424 CC1(NC(=O)c2cnn3ccc(N4[C@H](CO)CC[C@@H]4c4cncc(F)c4)nc23)CC1 CHEMBL3676079
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
425 C=CCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL561670
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
426 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCCNCC2CCc3ccc(O)cc3O2)c1.[Br-] CHEMBL3612361
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
427 Cc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CC3)c2n1 CHEMBL3676049
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
428 O=C(N[C@@H]1CCCC[C@H]1O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676010
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
429 CN1CCCC1c1cnc2cc3ccncc3cc2c1 CHEMBL61883
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
430 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1cnccn1 CHEMBL1808875
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
431 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CCN(CCO)CC3)c2n1 CHEMBL3676030
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
432 CCCCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL55606
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
433 CN1C(=[Se])CC[C@H]1c1cccnc1.C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C CHEMBL3114540
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
434 C[N+]1([O-])CCC[C@H]1c1cccnc1 CHEMBL3544718
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
435 O=C(c1cnccn1)N1CCCC1c1ccc(-c2cccc(Cl)c2)nc1 CHEMBL1808870
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
436 CN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1 CHEMBL2165407
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
437 CCCC/C=C/CC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL562649
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
438 Cn1cccc1-c1cc(C(=O)N2CCCC2c2cccnc2)[nH]n1 CHEMBL3486928
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
439 Cc1cncc([C@@H]2CCC[N+]2(C)[O-])c1 CHEMBL3640778
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
440 Cc1cc(-c2cccc(Cl)c2)ncc1C1CC(O)CN1C(=O)C1CCC1 CHEMBL1808897
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
441 CC(C)(CF)NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675946
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
442 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[Br-].[Br-] CHEMBL105342
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
443 CCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL3612356
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
444 CONC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675948
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
445 Cc1cc(-c2cccc(Cl)c2)ncc1C1CC(F)CN1C(=O)c1cnccn1 CHEMBL1806522
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
446 CN1[C@H](c2ccccc2)CC[C@H]1c1cccnc1 CHEMBL116998
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
447 O=C(c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CCCCC1 CHEMBL3676011
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
448 CCc1cncc(C2CCCN2C)c1 CHEMBL111526
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
449 CN1CCCC1c1ccc[n+](CCCc2ccc(-c3ccc(CCC[n+]4cccc(C5CCCN5C)c4)cc3)cc2)c1.[Br-].[Br-] CHEMBL592152
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
450 CN1CCC[C@H]1c1ccc[n+](CCCC#Cc2cc(C#CCCC[n+]3cccc([C@@H]4CCCN4C)c3)c(C#CCCC[n+]3cccc([C@@H]4CCCN4C)c3)cc2C#CCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL2368834
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
451 CCN1C(=S)N2CCCC2c2c1nc(-c1cccc(OC)c1)c(C#N)c2N1CCOCC1 CHEMBL3589376
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
452 COc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2csc(C)c2)cc1 CHEMBL3674838
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
453 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)N3CC(O)C3)c2n1 CHEMBL3676060
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
454 CN1CCC[C@H]1c1ccc[n+](CCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1179945
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
455 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccon3)cc2)C1c1cccnc1OCCO CHEMBL3669819
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
456 CCCCCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21 CHEMBL1179033
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
457 O=C(N[C@H]1CCC[C@H]1O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675978
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
458 O=C(N[C@@H]1CCC[C@@H]1O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676009
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
459 CN1CCC[C@H]1c1cccnc1.O=C(O)C(O)C(O)C(=O)O CHEMBL1448280
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
460 CCCC/C=C\CC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL560330
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
461 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(SC)cc1 CHEMBL3679751
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
462 CCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21.[I-] CHEMBL54225
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
463 COC(=O)N1CC[C@@H]2C=Cc3cc(Cl)nc(Cl)c3[C@@H]21 CHEMBL374956
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
464 CCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL3612357
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
465 CCCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21 CHEMBL1185930
5
1ade252ebe08 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
bgruening
parents: 3
diff changeset
466 NC(=O)c1ccc(Oc2ccc(CN3CCC[C@H]3c3cccnc3)cc2)c(Cl)c1 CHEMBL1921842
8
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
467 CN1C(=O)[C@H](O)C[C@@H]1c1cccnc1 CHEMBL3126034
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
468 CN1CCC[C@H]1c1ccc[n+](CCCCCNCC2CCc3ccc(O)cc3O2)c1.[Br-] CHEMBL3612358
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
469 COc1ccnc(OC)c1C1CC(C)C(=O)N1Cc1ccc2oc3ccccc3c2c1 CHEMBL3985834
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
470 O=C(NC1COC1)c1cc2c(N3CCCC3c3cccnc3)ccnc2[nH]1 CHEMBL4083992
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
471 CN1C[C@@H](O)C[C@H]1c1cccnc1 CHEMBL117339
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
472 C[C@H](NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cn(C)c3=O)nc12)C1CC1 CHEMBL3676098
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
473 CN1CC[C@H]2CCc3c(ccc[n+]3[BH2-]C#N)[C@H]21 CHEMBL277416
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
474 CCCCC#CCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197029
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
475 Nc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)N3CCC3)c2n1 CHEMBL3676086
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
476 CC[C@@H](NC(=O)c1cc(C(=O)N2CCC[C@@H]2c2ccc(OC)nc2)n2c1COCC2)c1ccccc1 CHEMBL4115509
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
477 CN1CCC[C@H]1c1ccc[n+](CCCCCc2ccccc2CCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1182431
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
478 CC(=O)N1CCCC1c1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1 CHEMBL3900434
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
479 CN1CCCC1c1cncc(F)c1 CHEMBL62128
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
480 COCCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)o2)cc1 CHEMBL3679737
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
481 C[C@H]1C[C@@H](c2cccnc2)N(C)C1 CHEMBL432837
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
482 Cc1cc(-c2cccc(Cl)c2)ncc1C1CC(O)CN1C(=O)c1nccs1 CHEMBL1808896
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
483 CN1CCC[C@@]12CCc1ccncc12 CHEMBL2111861
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
484 Cc1cc(-c2cccc(F)c2)ncc1C1CCCN1C(=O)c1cncs1 CHEMBL1808888
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
485 CN1CCC[C@@H]1c1cccnc1.Cc1ccc(C(=O)OC(C(=O)O)C(OC(=O)c2ccc(C)cc2)C(=O)O)cc1 CHEMBL2448607
5
1ade252ebe08 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
bgruening
parents: 3
diff changeset
486 O=C(C(Nc1ccccc1F)c1ccc(C(F)(F)F)cc1)N1CCCC1c1cccnc1 CHEMBL2348671
8
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
487 CN1CCC[C@H]1c1ccc[n+]([C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)c1 CHEMBL3544704
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
488 CC(C)NC(=O)c1cnn2ccc(N3[C@@H](c4cncc(F)c4)CC[C@@]3(C)CO)nc12 CHEMBL3676084
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
489 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccco2)cc1 CHEMBL3669766
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
490 CCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL56296
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
491 COc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)C1CCC1 CHEMBL1808885
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
492 CC(C)(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3cccs3)cc2)C1c1cccnc1OCCO CHEMBL3669814
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
493 CN1C[C@@H](OS(C)(=O)=O)C[C@H]1c1cccnc1 CHEMBL119186
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
494 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCCCO)c2n1 CHEMBL3676019
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
495 C[N@@+]1(Cc2ccc(Cl)c(Cl)c2)CCC[C@@H]1c1ccc[n+](Cc2ccc(Cl)c(Cl)c2)c1 CHEMBL1318824
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
496 CN1C(=[Se])CC[C@H]1c1cccnc1.C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@@]21C CHEMBL3114535
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
497 COCCOc1ncccc1[C@@H]1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674905
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
498 COC(=O)N1CC[C@@H]2CCc3ccncc3[C@@H]21 CHEMBL224871
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
499 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1185546
5
1ade252ebe08 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
bgruening
parents: 3
diff changeset
500 Cn1cc(NC(=O)N2CCCC2c2cccnc2)ccc1=O CHEMBL3453894
8
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
501 CN1C(=O)[C@H](O)C[C@H]1c1cccnc1 CHEMBL1614639
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
502 O=C(Nc1ccc(F)cn1)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675970
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
503 CN1CCCC1c1cncc(Cl)c1 CHEMBL61013
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
504 CCCCCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21.[I-] CHEMBL55211
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
505 Cc1cc(-c2cccc(Cl)c2)ncc1[C@H]1CCCN1C(=O)c1nccs1 CHEMBL1808901
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
506 COc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1cncs1 CHEMBL1808884
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
507 O=C(c1cc(-c2ccc(O)cc2)n[nH]1)N1CCCC1c1cccnc1 CHEMBL3474057
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
508 CCCc1ccc(C2CCCN2C)cn1 CHEMBL103537
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
509 O=C(c1cncs1)N1CCCC1c1ccc(-c2cccc(Cl)c2)nc1 CHEMBL1808868
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
510 O=C(N[C@H]1CCC[C@@H]1O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675977
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
511 CNC(=O)c1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679832
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
512 Cc1ccc(Nc2ncc(C3CCCN3C(=O)c3nccs3)cc2Cl)cn1 CHEMBL3600431
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
513 Cc1nn(C)c(Oc2cccc(Cl)c2Cl)c1C(=O)N1CCCC1c1cccnc1 CHEMBL2336227
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
514 O=C(NC1(CO)CC1)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675981
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
515 CCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C.[I-] CHEMBL52088
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
516 COCCOc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)o2)cc1 CHEMBL3674875
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
517 NC(=O)c1cnn2ccc(N3CCCC3c3cc(F)cnc3CO)nc12 CHEMBL3675957
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
518 CCc1ccc(C2CCCN2C)cn1 CHEMBL103225
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
519 CC1CCN(C)[C@@H]1c1cccnc1 CHEMBL119019
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
520 CC(C)(C#N)NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675944
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
521 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[I-].[I-] CHEMBL106542
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
522 CN1CCC[C@H]1c1ccc[n+](CCCCCc2ccccc2CCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[Br-].[Br-] CHEMBL238768
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
523 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)N[C@H]3CC[C@H](O)C3)c2n1 CHEMBL3676025
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
524 CCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL293527
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
525 CCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1183372
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
526 COCCN(C)C(=O)c1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679840
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
527 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3cccs3)cc2)C1c1cccnc1OCCO CHEMBL3674756
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
528 Cc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2cccs2)cc1 CHEMBL3669787
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
529 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)C1c1cccnc1OCCCO CHEMBL3679825
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
530 O=C(NC1(C(F)(F)F)CC1)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675973
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
531 Cc1ncsc1CCC(=O)N1CCCC1c1cccnc1 CHEMBL3476252
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
532 Cc1ncc(C2CCCN2C)c2c1[nH]c1ccccc12 CHEMBL500286
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
533 CCCC/C=C\CC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197132
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
534 CN1CCC[C@H]1c1ccc[n+](CCCCCc2cc(CCCCC[n+]3cccc([C@@H]4CCCN4C)c3)c(CCCCC[n+]3cccc([C@@H]4CCCN4C)c3)cc2CCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[Br-].[Br-].[Br-].[Br-] CHEMBL449337
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
535 COCC1CCN(C)[C@@H]1c1cccnc1 CHEMBL119020
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
536 Cc1ccc(C2CCCN2C)cn1 CHEMBL294757
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
537 CCCCCCC#CCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197164
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
538 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1179963
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
539 C[C@@H]1CCc2ncc(F)cc2[C@H]2CCCN2c2ccn3ncc(c3n2)C(=O)N1 CHEMBL4297627
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
540 CN1CCC2CCc3ccncc3C21 CHEMBL324227
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
541 CCO.CN1CCC[C@H]1c1cccnc1 CHEMBL3137669
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
542 O=C(NC1CCC(O)CC1)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3902802
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
543 c1cncc(C2C3CCN2CC3)c1 CHEMBL130814
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
544 O=C(c1cccs1)N1CCCC1c1ccc(-c2cccc(Cl)c2)nc1 CHEMBL1808866
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
545 CN1CC[C@H]2CCc3ncccc3[C@H]21 CHEMBL281410
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
546 Cc1cc(-c2cccc(F)c2)ncc1C1CCCN1C(=O)c1cnccn1 CHEMBL1808889
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
547 Cc1cc(-c2cccc(Cl)c2)ncc1C1CC(O)CN1C(=O)c1cnccn1 CHEMBL1808898
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
548 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCNCC2CCc3ccc(O)cc3O2)c1 CHEMBL3614076
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
549 CN1C2CCc3ccncc3C1CC2 CHEMBL423579
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
550 CN1C(=S)CC[C@H]1c1cccnc1.C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C CHEMBL3114537
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
551 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)NC4CCC(O)CC4)c3n2)c1=O CHEMBL3937419
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
552 COCCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3679824
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
553 CCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21 CHEMBL1185506
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
554 COCCOc1ncccc1C1C(C(=O)C2CCCC2)C(=O)C(=O)N1c1ccc(-c2noc(C)n2)cc1 CHEMBL3679787
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
555 NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675991
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
556 CN1C(=[Se])CC[C@H]1c1cccnc1 CHEMBL3114542
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
557 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)C1CC(=O)N(C)C1 CHEMBL1808883
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
558 CN1CCCC1c1cccnc1Cl CHEMBL71112
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
559 Cc1cc(C(=O)N2CCCC2c2cnc(-c3cccc(Cl)c3)cc2C)no1 CHEMBL1808874
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
560 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1OCC(=O)O CHEMBL3669834
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
561 C#Cc1cncc([C@@H]2CCCN2C)c1.O=C(O)/C=C/C(=O)O CHEMBL2146093
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
562 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669765
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
563 CCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1189396
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
564 CCN1C(=O)CCC1c1cccnc1 CHEMBL3126031
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
565 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1OCCO CHEMBL3669817
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
566 CCCCCCC#CCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL561389
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
567 COCCOc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(SC)cc1 CHEMBL3669796
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
568 CN1CCC[C@H]1c1cccnc1.CN1CCC[C@H]1c1cccnc1.O=S(=O)(O)O CHEMBL3182465
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
569 CCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL558517
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
570 COc1ccc(C(C)(C)C)cc1CN[C@@H]1[C@H](c2cccnc2N(C)C)N(C(=O)C2CCCCC2)[C@H](C(=O)O)[C@H]1C(C)(C)C CHEMBL4176858
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
571 COC1CN(C(=O)c2cnn3ccc(N4CCC[C@@H]4c4cncc(F)c4)nc23)C1 CHEMBL3675971
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
572 COCCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2csc(C)c2)cc1 CHEMBL3679830
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
573 CN1CCCC1c1cnc2ccccc2c1 CHEMBL161944
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
574 Cc1cncc(C2CCCN2C)c1 CHEMBL364003
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
575 COc1ccnc(OC)c1C1CC(C)C(=O)N1Cc1csc(-c2ccc(C)cc2)n1 CHEMBL3926444
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
576 CCCCC/C=C/CCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL559110
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
577 CCc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)N[C@H]3CC[C@H](O)C3)c2n1 CHEMBL3676067
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
578 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCCCNC(=O)OC(C)(C)C)c2n1 CHEMBL3676015
a43a00845834 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit e062e8287369e08bacf084e445acbeceb38c8ede"
bgruening
parents: 5
diff changeset
579 O=C(NCC(F)F)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676008