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annotate test-data/out3.smi @ 3:8b6ba267714b draft

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"planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
author bgruening
date Wed, 01 Apr 2020 07:04:25 -0400
parents f56492688f43
children 1ade252ebe08
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3
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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diff changeset
1 CN1CCCC1c1cnccc1N CHEMBL193763
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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2 CC(C)(CO)NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676006
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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3 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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4 CN1CCCC1c1ccc(Br)nc1 CHEMBL58231
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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5 CN1CCC[C@H]1c1ccc[n+](CCCCCCNCC2CCc3ccc(O)cc3O2)c1 CHEMBL3614072
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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6 CN1[C@H](c2cccnc2)CC[C@@H]1c1ccccc1 CHEMBL443018
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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7 O=C(N[C@@H]1CCC[C@H]1O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676007
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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diff changeset
8 COCCOc1ncccc1[C@@H]1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674905
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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9 CC1(NC(=O)c2cnn3ccc(N4CCC[C@@H]4c4cncc(F)c4)nc23)CC1 CHEMBL3675966
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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10 CS(=O)(=O)N1CCC(NC(=O)c2cnn3ccc(N4CCCC4c4cncc(F)c4)nc23)CC1 CHEMBL3675945
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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11 CN1CCCC1c1cccnc1 CHEMBL440464
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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12 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[Br-].[Br-] CHEMBL420649
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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13 O=C(N[C@@H]1C2CC[C@@H](C2)[C@@H]1CO)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3676012
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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14 O=C(N[C@H]1CC[C@H](O)C1)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675979
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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15 CN1C(=O)[C@@H](C(N)=O)C[C@@H]1c1cccnc1 CHEMBL3126036
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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16 CCCCC/C=C/CCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL559110
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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17 C[N@@+]1(Cc2ccc(Cl)c(Cl)c2)CCC[C@@H]1c1ccc[n+](Cc2ccc(Cl)c(Cl)c2)c1 CHEMBL1318824
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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18 CC1=C[C@H]2Cc3[nH]c(=O)ccc3[C@@]3(C1)[C@@H]2[C@H](C)CN3C CHEMBL2409141
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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19 CC1CN(C)[C@H](c2cccnc2)C1C CHEMBL334222
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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20 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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21 c1cc2c(cn1)[C@@H]1N3CCC1(CC3)C2 CHEMBL2111859
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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22 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1Cl CHEMBL3674784
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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23 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2csc(C)c2)cc1 CHEMBL3674792
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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24 COc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)Nc3cc(C)n[nH]3)c2n1 CHEMBL3676102
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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25 COc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669826
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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26 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccon3)cc2)C1c1cccnc1OCCO CHEMBL3669819
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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27 C=CC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL558518
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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28 CCCCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21 CHEMBL1185915
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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29 COCCOc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2cccs2)cc1 CHEMBL3669795
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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30 CN1CCCC1c1ccc(Nc2c(C(=O)C3CC3)cnc3ccc(-c4cc(F)c(O)c(Cl)c4)cc23)nc1 CHEMBL3674294
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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31 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCCNCC2CCc3ccc(O)cc3O2)c1.[Br-] CHEMBL3612361
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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32 CCCCc1ccc(C2CCCN2C)cn1 CHEMBL320023
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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33 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)C1c1cccnc1OCCO CHEMBL3674760
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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34 CN1CCC[C@H]1c1ccc[n+](CCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[I-].[I-] CHEMBL105440
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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35 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)OC(C)C)cc2)s1 CHEMBL3679770
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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36 CCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197124
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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37 CCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL3614075
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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38 Cc1ccc(-c2cc(C(=O)N3CCCC3c3cccnc3)[nH]n2)o1 CHEMBL3485246
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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39 CN1CCC[C@H]1c1ccc[n+](CCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[I-].[I-] CHEMBL104461
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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40 CNC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cnc3OC)nc12 CHEMBL3676024
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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41 Cc1cncc(C2CCCN2C)c1 CHEMBL364003
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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42 CC1(O)CN(C(=O)c2cnn3ccc(N4CCC[C@@H]4c4cncc(F)c4)nc23)C1 CHEMBL3675967
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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43 CN1CCC[C@H]1c1ccc(Nc2ncc3cc(Br)c(=O)n(C4CCCC4)c3n2)nc1 CHEMBL3990288
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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44 CCCCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL55606
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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45 COc1ncccc1C1C(C(=O)CC(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674964
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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46 CC[C@H]1C[C@@H](c2cccnc2)N(C)C1 CHEMBL115793
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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47 CCNC(=O)c1cc2c(N3CCCC3c3cccnc3)ccnc2[nH]1 CHEMBL4064004
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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48 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1183837
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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diff changeset
49 CCOc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674943
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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diff changeset
50 CCCCC#CCCCCCC[n+]1cccc(C2CCCN2C)c1.[Br-] CHEMBL599540
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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diff changeset
51 C#Cc1cncc([C@@H]2CCCN2C)c1 CHEMBL111659
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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52 CCCCCCCCCC[n+]1cccc2c1CC[C@]1(C)CCN(C)[C@]21C CHEMBL1183842
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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diff changeset
53 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)o2)cc1 CHEMBL3674872
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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diff changeset
54 COc1cc(-c2ccc3ncc(C(=O)C4CC4)c(Nc4ccc(C5CCCN5C)cn4)c3c2)cc(Cl)c1O CHEMBL3674295
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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55 CC(C)NC(=O)c1cnn2ccc(N3[C@H](CO)CC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676080
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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56 O=C(c1cccs1)N1CCCC1c1ccc(-c2cccc(Cl)c2)nc1 CHEMBL1808866
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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diff changeset
57 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC[C@@H](O)CO)c2n1 CHEMBL3676021
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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58 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[Br-].[Br-] CHEMBL105342
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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59 O=C1NC(=O)/C(=C/c2cnn3c(NC4CC4)nc(N4CCCC4c4cccnc4)nc23)N1 CHEMBL3984229
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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diff changeset
60 CN1C(=O)CC[C@H]1c1ccc[n+]([O-])c1 CHEMBL3544793
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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61 Cn1cc(NC(=O)N2CCCC2c2cccnc2)ccc1=O CHEMBL3453894
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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62 CCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL538685
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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63 O=C(NC1CC1)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675929
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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64 Cc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CC3)c2n1 CHEMBL3676049
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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65 O=C(Nc1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CC[C@H](O)C1 CHEMBL3944177
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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66 COCCOc1ncccc1[C@@H]1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679738
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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67 CCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1183372
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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68 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)NC(C)C)cc2)s1 CHEMBL3679837
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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diff changeset
69 C=CS(=O)(=O)[C@H]1C[C@]2(C(=O)OC)CCC(=O)N2[C@H]1c1cccnc1 CHEMBL493120
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
70 C[C@@H]1CCc2ncc(F)cc2[C@H]2CCCN2c2ccn3ncc(c3n2)C(=O)N1 CHEMBL4297627
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
71 CCO.CN1CCC[C@H]1c1cccnc1 CHEMBL3137669
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
72 CCc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CCC(O)CC3)c2n1 CHEMBL3971680
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
73 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
74 CN1CCC[C@H]1c1ccc[n+]([C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)c1 CHEMBL3544704
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
75 CC(C)(CO)CNC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675999
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
76 COc1ccc(CN2C(=O)CCC2c2cccnc2)cc1 CHEMBL3126032
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
77 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
78 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
79 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)C1CCC1 CHEMBL1808881
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
80 COc1ccnc(OC)c1C1CC(C)C(=O)N1Cc1cccc(-c2nc(Cl)cs2)c1 CHEMBL3943155
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
81 COC(=O)N1CC[C@@H]2CCc3ccncc3[C@@H]21 CHEMBL224871
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
82 CCc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)NCC(C)(C)O)c2n1 CHEMBL3676068
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
83 CC(C)(C#N)NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675944
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
84 CN1CCCC1c1cccnc1.O=S(=O)(O)O CHEMBL2142095
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
85 CN1C(=O)[C@@H](O)C[C@@H]1c1cccnc1 CHEMBL3126033
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
86 CC(C)(C)NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675930
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
87 O=C(N[C@@H]1CCC[C@@H]1O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676009
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
88 CCN(C)C(=O)[C@H]1C[C@@](CC(C)C)(C(=O)OC)N(C)[C@H]1c1cccnc1 CHEMBL3475081
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
89 Cc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccco2)cc1 CHEMBL3669788
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
90 CC1(NC(=O)c2cnn3ccc(N4[C@H](CO)CC[C@@H]4c4cncc(F)c4)nc23)CC1 CHEMBL3676079
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
91 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
92 Cc1ncsc1CCC(=O)N1CCCC1c1cccnc1 CHEMBL3476252
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
93 CN1C(=O)CCC1c1cccnc1 CHEMBL664
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
94 CCN1CCCC1c1cccnc1 CHEMBL163042
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
95 C[C@H](NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cn(C)c3=O)nc12)C1CC1 CHEMBL3676098
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
96 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
97 CCCc1ccc(C2CCCN2C)cn1 CHEMBL103537
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
98 c1cncc(C2CCCN2C2c3ccccc3Oc3ccccc32)c1 CHEMBL278775
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
99 CCCCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21.[I-] CHEMBL441186
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
100 COCCOc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674772
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
101 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)N3CCCC3)cc2)s1 CHEMBL3679838
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
102 CC(C)C[C@H](N[C@H](CCN1C(=O)c2cc3ccccc3cc2C1=O)C(=O)O)C(=O)N1CCCC1c1cccnc1 CHEMBL158622
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
103 O=C(NC1(CO)CC1)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675981
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
104 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCC(O)CO)c2n1 CHEMBL3676020
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
105 COCCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)o2)cc1 CHEMBL3679737
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
106 C[C@@H](NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cn(C)c3=O)nc12)C1CC1 CHEMBL3676097
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
107 CN1C[C@@H](OS(C)(=O)=O)C[C@H]1c1cccnc1 CHEMBL119186
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
108 CCCCCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C CHEMBL1183493
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
109 CN1CC[C@H]2CCc3c(ccc[n+]3[BH2-]C#N)[C@H]21 CHEMBL277416
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
110 CN1CCC2CCc3ccncc3C21 CHEMBL324227
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
111 CCCC/C=C/CC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL562649
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
112 CN1CCCC1c1ccc(Nc2cc(-c3cc(F)cc(N4CCc5c(sc6c5CC(C)(C)C6)C4=O)c3CO)cn(C)c2=O)nc1 CHEMBL3670116
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
113 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccoc2)cc1 CHEMBL3669767
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
114 CCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL293527
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
115 CC1(NC(=O)c2cnn3ccc(N4CCCC4c4cncc(F)c4)nc23)CCC1 CHEMBL3675976
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
116 COc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674810
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
117 C[C@H](NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12)C(F)(F)F CHEMBL3676004
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
118 O=C(N[C@@H]1CCCC[C@H]1O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676010
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
119 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)N[C@H]3CN4CCC3CC4)c2n1 CHEMBL3676065
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
120 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[Br-].[Br-] CHEMBL54826
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
121 CCCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C.[I-] CHEMBL57108
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
122 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3674791
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
123 O=C(NC1(C(F)(F)F)CC1)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675973
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
124 CC1CCN(C)[C@@H]1c1cccnc1 CHEMBL119019
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
125 O=C(NCC(F)CCl)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675972
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
126 CNC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675988
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
127 CN1CCCC1c1ccc(C(=O)O)nc1 CHEMBL370709
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
128 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(SC)cc1 CHEMBL3679751
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
129 O=C(NC1CCN(Cc2ccn(-c3ccc(C(F)(F)F)cc3)c2)CC1)N1CCCC1c1cccnc1 CHEMBL560283
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
130 CCc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CC3)c2n1 CHEMBL3676050
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
131 CN1CCC[C@H]1c1ccc(Nc2ncc3cc(Br)c(=O)n(C4CCCC4)c3n2)nc1.Cl CHEMBL3972301
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
132 CCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1194306
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
133 CN1CCC[C@H]1c1ccc[n+](CCCC#Cc2ccccc2C#CCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[Br-].[Br-] CHEMBL238769
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
134 O=S(=O)(Nc1ncns1)c1ccc2c(N3CCC[C@@H]3c3cccnc3)cccc2c1 CHEMBL3682682
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
135 CN1CCCC1c1ccc(CC(O)c2ccccc2)nc1 CHEMBL363379
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
136 COc1ccncc1C1CCCN1C CHEMBL370168
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
137 c1ccc(CN2CCCC2c2cccnc2)cc1 CHEMBL163552
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
138 COCCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3679824
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
139 CCCCCCC#CCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197164
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
140 COCCNC(=O)c1cnn2ccc(N3CCCC3c3cc(F)cnc3C)nc12 CHEMBL3676059
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
141 CN1CCCC1c1ccc(-c2ccccc2)nc1 CHEMBL350748
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
142 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2noc(C)n2)cc1 CHEMBL3669816
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
143 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)N3CC(C)(O)C3)c2n1 CHEMBL3676018
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
144 O=C(NCC(F)F)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676008
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
145 Cc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC(C)(C)C)c2n1 CHEMBL3676051
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
146 Cc1cc(-c2cccc(F)c2)ncc1C1CCCN1C(=O)c1cnccn1 CHEMBL1808889
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
147 C[C@@H](NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)C1CC1 CHEMBL3675997
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
148 COCCOc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669785
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
149 O=C(NCCO)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675986
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
150 CCc1cc(NC(=O)c2cnn3ccc(N4CCCC4c4cc(F)cnc4OC)nc23)[nH]n1 CHEMBL3676105
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
151 CN1CCC[C@H]1c1cccnc1.Cl CHEMBL225057
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
152 C[C@@H]1CC[C@@H](c2cccnc2)N1C CHEMBL118038
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
153 CN1CCCC1c1ccc[n+](CCCc2ccc(-c3ccc(CCC[n+]4cccc(C5CCCN5C)c4)cc3)cc2)c1.[Br-].[Br-] CHEMBL592152
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
154 CN1CCCC1c1ccc(CCCc2ccccc2)nc1 CHEMBL361703
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
155 CNC(=O)c1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679832
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
156 O=C(NC1CCC1)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675975
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
157 CN1C[C@@H](CC#N)C[C@H]1c1cccnc1 CHEMBL334001
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
158 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)Nc4ccc(F)cn4)c3n2)c1=O CHEMBL3676101
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
159 CCCCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C.[I-] CHEMBL52983
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
160 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3OCCO)cc2)o1 CHEMBL3679749
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
161 COCCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccoc2)cc1 CHEMBL3679826
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
162 COc1cncc(C2CCCN2C)c1 CHEMBL303530
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
163 COC1CN(C(=O)c2cnn3ccc(N4CCC[C@@H]4c4cncc(F)c4)nc23)C1 CHEMBL3675971
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
164 O=C(NCC(F)(F)F)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3676005
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
165 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)NC3CCC3)c2n1 CHEMBL3676053
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
166 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccco2)cc1 CHEMBL3669766
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
167 C[C@@H](CO)NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675990
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
168 CCCC[C@H]1CC[C@@H](c2cccnc2)N1C CHEMBL119581
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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diff changeset
169 C[C@H]1C[C@@H](c2cccnc2)N(C)C1 CHEMBL432837
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
170 O=C(NC1COC1)c1cc2c(N3CCCC3c3cccnc3)ccnc2[nH]1 CHEMBL4083992
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
171 NC(=O)c1ccc(Oc2ccc(CN3CCCC3c3cccnc3)cc2)c(Cl)c1 CHEMBL1921841
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
172 Cc1ccc(NC(=O)c2cnn3ccc(N4CCC[C@@H]4c4cc(F)cn(C)c4=O)nc23)cn1 CHEMBL3676091
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
173 CN1CCC[C@@H]1c1cccnc1.Cc1ccc(C(=O)OC(C(=O)O)C(OC(=O)c2ccc(C)cc2)C(=O)O)cc1 CHEMBL2448607
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
174 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669765
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
175 CN1CCC[C@H]1c1ccc[n+](CCCCCc2ccccc2CCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1182431
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
176 CCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL56296
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
177 CCOc1ccc(N2C(=O)C3=NCCNC(c4ccc(Cl)cc4)=C3C2c2cccnc2)cc1 CHEMBL1325781
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
178 COc1ccnc(OC)c1C1CC(C)C(=O)N1Cc1ccc2oc3ccccc3c2c1 CHEMBL3985834
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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diff changeset
179 CN1CCC[C@H]1c1ccc[n+](C)c1.[I-] CHEMBL541771
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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diff changeset
180 CN1C(=S)CC[C@H]1c1cccnc1 CHEMBL3114543
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
181 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
182 CC(C)(CF)NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675946
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
183 CCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL559757
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
184 O=C(C1CCC1)N1CCCC1c1ccc(-c2cccc(Cl)c2)nc1 CHEMBL1808871
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
185 CN1C[C@@H](Cc2ccccc2)C[C@H]1c1cccnc1 CHEMBL420694
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
186 COCc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674842
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
187 CCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1196877
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
188 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
189 CC(C)NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675968
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
190 NC(=O)c1ccc(Oc2ccc(CN3CCCC3c3cccnc3)cc2)c2ccccc12 CHEMBL4095563
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
191 CCCc1cc(C(=O)N2CCCC2c2cccnc2)[nH]n1 CHEMBL3486295
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
192 C=CCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL563663
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
193 CN1CCC[C@H]1c1ccc[n+](CCCC#Cc2cccc(C#CCCC[n+]3cccc([C@@H]4CCCN4C)c3)c2)c1 CHEMBL1185135
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
194 CN1C(=O)C(C(=O)O)C[C@@H]1c1cccnc1 CHEMBL3126035
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
195 CC(=O)[C@H]1OC([n+]2cccc([C@@H]3CCC(=O)N3C)c2)[C@H](O)[C@@H](O)[C@@H]1O CHEMBL3559662
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
196 Cc1cc(-c2cccc(Cl)c2)ncc1C1CC(F)CN1C(=O)c1cncs1 CHEMBL1808899
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
197 CCN1C(=O)CCC1c1cccnc1 CHEMBL3126031
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
198 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CCC(O)CC3)c2n1 CHEMBL3904952
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
199 CCOc1ncccc1C1C(C(=O)C2CCCC2)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3679781
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
200 CC(C)(O)CNC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675985
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
201 CCCC/C=C\CC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL560330
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
202 CCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674944
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
203 CCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL558517
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
204 CC(NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12)C1CC1 CHEMBL3675987
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
205 CCCCCCC#CCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL561389
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
206 CN1CCCC1c1ccc[n+](CCCc2ccc(-c3ccc(CCC[n+]4cccc(C5CCCN5C)c4)cc3)cc2)c1 CHEMBL1197966
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
207 COc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1cncs1 CHEMBL1808884
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
208 CN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccnc1 CHEMBL2165407
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
209 C[C@H]1CC[C@@H](c2cccnc2)N1C CHEMBL116645
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
210 Cc1cc(-c2cccc(F)c2)ncc1C1CCCN1C(=O)c1cncs1 CHEMBL1808888
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
211 CNC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cnc3C)nc12 CHEMBL3676054
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
212 O=C(c1cnccn1)N1CCCC1c1ccc(-c2cccc(Cl)c2)nc1 CHEMBL1808870
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
213 Nc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)N3CCC3)c2n1 CHEMBL3676086
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
214 CO[C@H]1C[C@@H](c2cccnc2)N(C)C1 CHEMBL326597
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
215 O=C1CC[C@@H](c2cccnc2)N1CO CHEMBL3544621
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
216 c1cncc(C2C3CCN2CC3)c1 CHEMBL130814
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
217 CCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C CHEMBL1183508
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
218 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
219 CN1CCC[C@]12CCc1ccncc12 CHEMBL2112670
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
220 Cc1cc(-c2cccc(Cl)c2)ncc1C1CC(O)CN1C(=O)c1cnccn1 CHEMBL1808898
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
221 CC[C@@H](NC(=O)c1cc(C(=O)N2CCC[C@@H]2c2ccc(OC)nc2)n2c1COCC2)c1ccccc1 CHEMBL4115509
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
222 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)N[C@H]3CC[C@H](O)C3)c2n1 CHEMBL3676025
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
223 Cc1cc(-c2cccc(Cl)c2)ncc1C1CC(F)CN1C(=O)C1CCC1 CHEMBL1808900
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
224 C[N+]1(CC[N+]2(C)CCCC2c2cccnc2)CCCC1c1cccnc1 CHEMBL1978965
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
225 O=C(NC1CCC(O)CC1)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3902802
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
226 CC(C)(CF)NC(=O)c1cnn2ccc(N3CCCC3c3cc(F)cnc3CO)nc12 CHEMBL3675956
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
227 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)C1CCS(=O)(=O)C1 CHEMBL1808882
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
228 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1179025
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
229 CN1[C@H](C#N)CC[C@H]1c1cccnc1 CHEMBL81899
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
230 CN1CCCC1c1ccc(/C=C/c2ccccc2)nc1 CHEMBL190678
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
231 O=C(c1cncs1)N1CCCC1c1ccc(-c2cccc(Cl)c2)nc1 CHEMBL1808868
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
232 CN1C[C@@H](CO)C[C@H]1c1cccnc1 CHEMBL118849
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
233 CN1CCCC1c1ccc(O)nc1 CHEMBL72010
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
234 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1OCC(=O)O CHEMBL3669834
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
235 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3OC(C)C)cc2)o1 CHEMBL3679745
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
236 COCC(O)CNC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675993
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
237 CN1CCC[C@@H]1c1cccnc1 CHEMBL9732
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
238 CN1CCCC1c1ccc(Cl)nc1 CHEMBL70050
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
239 CSC[C@H]1C[C@@H](c2cccnc2)N(C)C1 CHEMBL119144
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
240 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCCCO)c2n1 CHEMBL3676019
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
241 CN1CCCC1c1cncc(F)c1 CHEMBL62128
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
242 CC(=O)N1CCCC1c1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1 CHEMBL3900434
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
243 COC(=O)N1CC[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)c3cc(Cl)nc(Cl)c3[C@@H]21 CHEMBL224667
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
244 CC(C)(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)C1c1cccnc1OCCO CHEMBL3669808
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
245 COC(=O)COCc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669821
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
246 CN1C(=O)CC[C@@]1(O)c1cccnc1 CHEMBL3544599
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
247 CC(C)(C)NC(=O)c1cnn2ccc(N3CCCC3c3cc(F)cnc3CO)nc12 CHEMBL3675955
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
248 Cc1cc(-c2cc(F)cc(Cl)c2)ncc1C1CCCN1C(=O)c1cnccn1 CHEMBL1808893
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
249 O=C(c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CC[C@H](O)C1 CHEMBL3676002
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
250 O=C(NC1CC1)c1cnn2ccc(N3CCCC3c3cc(F)cnc3CO)nc12 CHEMBL3675954
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
251 O=C(N[C@H]1CCC[C@@H]1O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675977
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
252 O=C(N[C@H]1CCC[C@H]1O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675978
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
253 CN1CCC[C@H]1c1ccc[n+](CCCC#Cc2cccc(C#CCCC[n+]3cccc([C@@H]4CCCN4C)c3)c2)c1.[Br-].[Br-] CHEMBL391220
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
254 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1185546
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
255 C=CCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197169
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
256 CCN1C(=S)N2CCCC2c2c1nc(-c1ccc(OC)c(O)c1)c(C#N)c2N1CCOCC1 CHEMBL3589378
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
257 O=C(c1cc2c([nH]c1=O)CCC2)N1CCCC1c1cccnc1 CHEMBL3458802
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
258 O=C(Nc1ccccc1F)N1CCCC1c1cccnc1 CHEMBL1870182
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
259 COCCOc1ncccc1C1C(C(=O)C2CCCC2)C(=O)C(=O)N1c1ccc(-c2ccon2)cc1 CHEMBL3679786
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
260 CN1CCC[C@H]1c1ccc[n+](CCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1179917
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
261 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CCN(CCO)CC3)c2n1 CHEMBL3676030
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
262 C=CC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1196878
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
263 CCCCCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21 CHEMBL1179033
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
264 CN1C[C@@H](O)C[C@H]1c1cccnc1 CHEMBL117339
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
265 CCCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21 CHEMBL1185930
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
266 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NOCCOC(C)(C)C)c2n1 CHEMBL3676023
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
267 NCCCNC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)c[nH]c3=O)nc12 CHEMBL3676016
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
268 COCc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669833
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
269 CCN1C(=S)N2CCCC2c2c1nc(-c1cccc(O)c1)c(C#N)c2N1CCOCC1 CHEMBL3589375
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
270 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)C1c1cccnc1OCCCO CHEMBL3679825
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
271 Cc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCCO)c2n1 CHEMBL3676056
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
272 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1OCCO CHEMBL3669817
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
273 CCCc1nn(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)Nc4ncccc4C4CCCN4C)ccc3OCC)nc12 CHEMBL2047881
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
274 CC(NC(=O)c1cnn2ccc(N3C(c4cncc(F)c4)CCC3(C)CO)nc12)C(F)(F)F CHEMBL3676085
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
275 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1179963
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
276 CNC(=O)COc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669837
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
277 COc1ccc(C2CCCN2C)cn1 CHEMBL292114
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
278 Cc1cc(C)nc(N2CCCC2c2cccnc2)n1 CHEMBL3436596
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
279 CN1CCC[C@H]1c1cccnc1 CHEMBL3
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
280 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1N1CCOCC1 CHEMBL3679789
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
281 CN1[C@H](c2ccccc2)CC[C@H]1c1cccnc1 CHEMBL116998
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
282 CC(C)(C)NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)c[nH]c3=O)nc12 CHEMBL3676069
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
283 CN1CCC[C@H]1c1ccc[n+](Cc2ccccc2)c1 CHEMBL1197228
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
284 COc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3674853
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
285 CC(=O)O[C@H]1C[C@@H](c2cccnc2)N(C)C1 CHEMBL419230
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
286 Cc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2cccs2)cc1 CHEMBL3669787
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
287 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCC(C)(C)O)c2n1 CHEMBL3676029
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
288 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
289 COCCOc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(SC)cc1 CHEMBL3669796
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
290 CCCCCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21.[I-] CHEMBL55211
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
291 CN1CC[C@@H]2CCc3ccncc3[C@@H]21 CHEMBL417278
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
292 COC(=O)N1CC[C@@H]2CCc3ccnc(Cl)c3[C@@H]21 CHEMBL374612
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
293 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCCO)c2n1 CHEMBL3676026
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
294 O=CN1CCC[C@H]1c1cccnc1 CHEMBL3126024
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
295 CC(C)NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cn(C)c3=O)nc12 CHEMBL3676089
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
296 C=CCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197241
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
297 CN1CCC[C@@]12CCc1ccncc12 CHEMBL2111861
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
298 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1ccncc1 CHEMBL1808880
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
299 NC(=O)c1cnn2ccc(N3CCCC3c3cc(F)cnc3CO)nc12 CHEMBL3675957
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
300 CN1CC[C@H]2CCc3ncccc3[C@H]21 CHEMBL281410
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
301 Cc1cc(-c2cc(F)cc(Cl)c2)ncc1C1CCCN1C(=O)c1cncs1 CHEMBL1808892
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
302 Cc1cc(-c2cccc(Cl)c2)ncc1C1CC(O)CN1C(=O)C1CCC1 CHEMBL1808897
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
303 CCCC/C=C\CC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197132
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
304 COc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2csc(C)c2)cc1 CHEMBL3674838
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
305 CN1CCCC1c1ccc(F)nc1 CHEMBL72470
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
306 COc1ccnc(OC)c1C1CC(C)C(=O)N1Cc1csc(-c2ccc(C)cc2)n1 CHEMBL3926444
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
307 CN1CCC[C@H]1c1ccc[n+](CCCCCCNCC2CCc3ccc(O)cc3O2)c1.[Br-] CHEMBL3612359
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
308 NC(=O)c1ccc(Oc2ccc(CN3CCC[C@@H]3c3cccnc3)cc2)c(Cl)c1 CHEMBL1921843
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
309 Cc1cc(-c2cccc(Cl)c2)ncc1[C@H]1CCCN1C(=O)c1nccs1 CHEMBL1808901
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
310 CN1CCC[C@H]1c1ccc[n+](CCCC#Cc2ccccc2C#CCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1182432
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
311 COCC(C)NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675992
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
312 NC(=O)c1ccc(Oc2ccc(CN3CCCC3c3cccnc3)cc2)nc1 CHEMBL1921840
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
313 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)NC3(CO)CC3)c2n1 CHEMBL3676061
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
314 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccoc2)cc1 CHEMBL3674761
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
315 CCCCC/C=C/CCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197030
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
316 CN1CCC[C@H]1c1cccnc1.CN1CCC[C@H]1c1cccnc1.O=S(=O)(O)O CHEMBL3182465
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
317 CCCCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C CHEMBL1178992
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
318 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)N[C@@H]4CCCC[C@H]4O)c3n2)c1=O CHEMBL3676096
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
319 c1cc2c(cn1)[C@H]1N3CCC1(CC3)C2 CHEMBL2112676
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
320 CCCCCOc1ccc(C[C@H](NC(=O)C2CC(=O)N(C)C2c2cccnc2)C(=O)O)cc1 CHEMBL352062
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
321 CN1CCC[C@H]1c1ccc[n+](Cc2ccccc2)c1.[Br-] CHEMBL563268
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
322 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)NCC4CC4)c3n2)c1=O CHEMBL3676094
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
323 CN1CCC[C@H]1c1ccc[n+]([BH2-]C#N)c1 CHEMBL282473
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
324 CCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL550723
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
325 O=C(C(Nc1ccccc1F)c1cc2ccccc2s1)N1CCCC1c1cccnc1 CHEMBL2348659
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
326 c1cc2c(cn1)[C@@H]1CCCN1CC2 CHEMBL3578316
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
327 CCNC(=O)c1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679793
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
328 CN1CCC[C@H]1c1ccc[n+](CCCCCc2ccccc2CCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[Br-].[Br-] CHEMBL238768
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
329 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2cccs2)nc1 CHEMBL3669770
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
330 Cc1nc2ccccc2n1Cc1ccc(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2CCCC2c2cccnc2)s1 CHEMBL1779603
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
331 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(N)=O)cc2)s1 CHEMBL3679831
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
332 CN1CCCC1c1ccc(Nc2c(C(=O)C3CC3)cnc3ccc(-c4cc(Cl)c(O)c(Cl)c4)cc23)nc1 CHEMBL3674296
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
333 CCCC[C@@H]1CC[C@@H](c2cccnc2)N1C CHEMBL119574
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
334 COc1ccc(CCc2ccc(C3CCCN3C)cn2)cc1 CHEMBL190652
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
335 CN1CCCC1c1cncc(C2CCCN2C)c1 CHEMBL3593860
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
336 O=C(NC1CCOCC1)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675947
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
337 O=C(C(Nc1ccccc1F)c1ccc(C(F)(F)F)cc1)N1CCCC1c1cccnc1 CHEMBL2348671
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
338 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)NC3(C)CC3)c2n1 CHEMBL3676058
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
339 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3OCCCO)cc2)o1 CHEMBL3679744
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
340 CCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C CHEMBL1178973
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
341 CCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21 CHEMBL1185506
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
342 CC(C)(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1OCCO CHEMBL3669809
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
343 CCN1C(=S)N2CCCC2c2c1nc(-c1cccc(OC)c1)c(C#N)c2N1CCOCC1 CHEMBL3589376
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
344 CN1CCC[C@H]1c1ccc[n+](CCCCc2ccc(CCCC[n+]3cccc([C@@H]4CCCN4C)c3)cc2)c1.[Br-].[Br-] CHEMBL238117
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
345 CCc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)N[C@H]3CC[C@H](O)C3)c2n1 CHEMBL3676067
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
346 CN1[C@H](c2cccnc2)CC[C@@H]1C#N CHEMBL84210
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
347 COc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2csc(C)c2)cc1 CHEMBL3674886
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
348 O=C(c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CCCC1 CHEMBL3675969
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
349 O=C(NOCCO)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cnc3Cl)nc12 CHEMBL3676087
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
350 C=CCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL561470
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
351 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC[C@H](O)CO)c2n1 CHEMBL3676017
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
352 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)N[C@@H]3CCC[C@H]3O)c2n1 CHEMBL3676064
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
353 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(SC)cc1 CHEMBL3669735
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
354 CN1C[C@H](C#N)C[C@H]1c1cccnc1 CHEMBL119352
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
355 CN1C(=O)[C@H](O)C[C@H]1c1cccnc1 CHEMBL1614639
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
356 c1cc2c(cn1)C1N3CCCC1(CC3)C2 CHEMBL335828
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
357 CCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL3612356
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
358 CN1CCCC1c1ccc(Nc2cc(-c3cc(F)cc(N4CCc5c(sc6c5CCCC6)C4=O)c3CO)cn(C)c2=O)nc1 CHEMBL3670117
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
359 CN1CCC[C@H]1c1ccc[n+](C)c1 CHEMBL1190855
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
360 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1ccncn1 CHEMBL1808876
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
361 CCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21 CHEMBL1179016
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
362 C#Cc1cncc([C@H]2CCCN2C)c1 CHEMBL1788226
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
363 c1cc2c(cn1)C1CCCN1CC2 CHEMBL3578314
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
364 Cc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669789
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
365 O=C1CC[C@]2(c3cccnc3)O[C@@H](COc3ccc(Cl)cc3)CN12 CHEMBL442410
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
366 CN1C(=O)CC[C@@H]1c1cccnc1 CHEMBL365343
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
367 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)NC4(C)CC4)c3n2)c1=O CHEMBL3676099
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
368 COCCOc1ncccc1C1C(C(=O)CC(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674965
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
369 CC(C)(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3cccs3)cc2)C1c1cccnc1OCCO CHEMBL3669814
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
370 C[C@H](O)CNC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675983
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
371 COc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)C1CCC1 CHEMBL1808885
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
372 Cc1cc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3OCCCO)cc2)cs1 CHEMBL3679829
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
373 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
374 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3cccs3)cc2)C1c1cccnc1OCCO CHEMBL3674756
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
375 Cc1ncc(C2CCCN2C)c2c1[nH]c1ccccc12 CHEMBL500286
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
376 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1nccs1 CHEMBL1808872
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
377 CCCCCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C.[I-] CHEMBL300598
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
378 CONC(=O)c1cnn2ccc(N3CCCC3c3cc(F)cnc3CO)nc12 CHEMBL3675958
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
379 COc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3674850
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
380 Cc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC(C)C)c2n1 CHEMBL3676052
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
381 CN1C(=O)CCC1c1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1 CHEMBL3925012
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
382 CN1C(=O)[C@H](O)C[C@@H]1c1cccnc1 CHEMBL3126034
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
383 Cc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC[C@@H](C)O)c2n1 CHEMBL3676057
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
384 O=C(c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CC(CO)C1 CHEMBL3676001
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
385 Cc1nn(C)c(Oc2cccc(Cl)c2Cl)c1C(=O)N1CCCC1c1cccnc1 CHEMBL2336227
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
386 Cc1cc(-c2cc(F)cc(F)c2)ncc1C1CCCN1C(=O)c1cnccn1 CHEMBL1808891
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
387 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)NCC#N)cc2)s1 CHEMBL3679836
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
388 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCNCC2CCc3ccc(O)cc3O2)c1.[Br-] CHEMBL3612360
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
389 CONC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675948
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
390 c1cncc(C2CCCN2c2ccnc3[nH]ncc23)c1 CHEMBL4066892
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
391 CN1CCCC1c1ccc(CCc2ccccc2)nc1 CHEMBL190295
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
392 COCCOc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccoc2)cc1 CHEMBL3669807
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
393 CC(C)[C@@H](CO)NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675995
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
394 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1cncs1 CHEMBL1808873
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
395 CN1CCC[C@H]1c1ccc[n+](CCCCCc2cc(CCCCC[n+]3cccc([C@@H]4CCCN4C)c3)cc(CCCCC[n+]3cccc([C@@H]4CCCN4C)c3)c2)c1 CHEMBL1182507
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
396 NC(=O)c1ccc(Oc2ccc(CN3CCC[C@H]3c3cccnc3)cc2)c(Cl)c1 CHEMBL1921842
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
397 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
398 CN1CCC[C@H]1c1ccc[n+](CCCCCNCC2CCc3ccc(O)cc3O2)c1.[Br-] CHEMBL3612358
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
399 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(N)=O)c2n1 CHEMBL3676055
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
400 CN1CCC(CO)[C@H]1c1cccnc1 CHEMBL325426
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
401 Cc1cc(-c2cc(C)c(C3CCCN3C(=O)c3cnccn3)cn2)ccn1 CHEMBL1808895
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
402 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[I-].[I-] CHEMBL320514
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
403 O=S(=O)(Nc1ncns1)c1ccc2c(N3CCC[C@H]3c3cccnc3)cccc2c1 CHEMBL3692144
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
404 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
405 O=C(c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CCC1 CHEMBL3676000
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
406 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)N[C@H]3CC[C@H](O)C3)c2n1 CHEMBL3676063
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
407 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCC[n+]2cccc([C@H]3CCCN3C)c2)c1 CHEMBL1194341
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
408 Cc1cc(-c2cccc(Cl)c2)ncc1C1CC(F)CN1C(=O)c1cnccn1 CHEMBL1806522
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
409 CN1C(=O)CC[C@@H]1c1ccc[n+]([O-])c1 CHEMBL3126028
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
410 CCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL3612357
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
411 COCCOc1ncccc1C1C(C(=O)C2CCCC2)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3679783
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
412 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1OCCCO CHEMBL3679823
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
413 CCCCC#CCCCCCC[n+]1cccc(C2CCCN2C)c1 CHEMBL1198250
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
414 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3OCCCO)cc2)s1 CHEMBL3679827
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
415 CN1CCC[C@@H]1c1ccc(Nc2cc(-c3cc(F)cc(N4CCn5c(cc6c5CC(C)(C)C6)C4=O)c3CO)cn(C)c2=O)nc1 CHEMBL3670119
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
416 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
417 C=CCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL561670
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
418 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1ccccn1 CHEMBL1808878
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
419 Cc1cc(-c2cc(F)cc(F)c2)ncc1C1CCCN1C(=O)c1cncs1 CHEMBL1808890
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
420 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC(CO)CO)c2n1 CHEMBL3676031
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
421 COc1ccnc(OC)c1C1CC(C)C(=O)N1Cc1cccc(-c2ccccc2)c1 CHEMBL3897027
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
422 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)C1CC(=O)N(C)C1 CHEMBL1808883
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
423 CCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21.[I-] CHEMBL417925
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
424 NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675991
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
425 O=C(C1CCC1)N1CCCC1c1cnc(-c2cccc(Cl)c2)cc1O CHEMBL1808886
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
426 CCN1C(=S)N2CCCC2c2c1nc(-c1ccc(OC)cc1)c(C#N)c2N1CCOCC1 CHEMBL3589377
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
427 O=C(NCC1CC1)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675980
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
428 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)Nc3ccn(C)n3)c2n1 CHEMBL3676103
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
429 CN1C(=O)CC[C@H]1c1ccc[n+](C)c1 CHEMBL3544791
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
430 C[N+]1([O-])CCC[C@H]1c1cccnc1 CHEMBL3544718
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
431 CCCCCCCCCC[n+]1cccc2c1CC[C@]1(C)CCN(C)[C@]21C.[I-] CHEMBL320633
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
432 CN1CCC[C@H]1c1ccc[n+](CCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1179945
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
433 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1cccnc1 CHEMBL1808879
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
434 CN1C(=[Se])CC[C@H]1c1cccnc1 CHEMBL3114542
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
435 CN1CCC(CF)[C@H]1c1cccnc1 CHEMBL119016
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
436 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
437 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
438 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
439 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
440 CCOC(=O)c1c(C)nc2c(C3CCCN3C)cccn12 CHEMBL2147747
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
441 O=C(c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12)N1CC(O)C1 CHEMBL3675982
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
442 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)NC(C)(C)C)c3n2)c1=O CHEMBL3676088
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
443 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC[C@H](C)O)c2n1 CHEMBL3676027
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
444 O=C(c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CCCCC1 CHEMBL3676011
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
445 CCc1cncc(C2CCCN2C)c1 CHEMBL111526
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
446 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2cccs2)cc1 CHEMBL3669764
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
447 CCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C.[I-] CHEMBL301648
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
448 CN1CCCC1c1ccc(CCc2ccc(Cl)cc2)nc1 CHEMBL189470
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
449 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2cccs2)cc1 CHEMBL3639736
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
450 COCC1CCN(C)[C@@H]1c1cccnc1 CHEMBL119020
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
451 Cc1cc(N2CCCC2c2cccnc2)nc(C)n1 CHEMBL3454373
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
452 COCCNC(=O)c1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679839
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
453 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)NC3CCC(O)CC3)c2n1 CHEMBL3955007
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
454 CN1CCCC1c1ccc(N)nc1 CHEMBL70774
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
455 CN1C2CCc3ccncc3C1CC2 CHEMBL423579
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
456 CCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1.I.[I-] CHEMBL1322435
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
457 Cc1nc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3OCCO)cc2)no1 CHEMBL3669818
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
458 Cc1ccc(Nc2ncc(C3CCCN3C(=O)c3nccs3)cc2Cl)cn1 CHEMBL3600431
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
459 C[C@@H](NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12)C(F)(F)F CHEMBL3676003
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
460 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1.[I-].[I-] CHEMBL106542
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
461 O=C(Nc1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)N1CC[C@@H](O)C1 CHEMBL4108902
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
462 COC(=O)N1CC[C@@H]2C[C@@H](Sc3ccccc3)c3cc(Cl)nc(Cl)c3[C@@H]21 CHEMBL225181
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
463 CCCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C CHEMBL1179053
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
464 CSc1ccc(N2C(=O)C(=O)C(C(=O)C(C)(C)C)C2c2cccnc2OCCO)cc1 CHEMBL3669813
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
465 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)NC4CC4)c3n2)c1=O CHEMBL3676090
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
466 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)NCCN(C)C)cc2)s1 CHEMBL3679841
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
467 CN1CCCC1c1cccnc1Cl CHEMBL71112
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
468 COC[C@H]1C[C@@H](c2cccnc2)N(C)C1 CHEMBL119227
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
469 CCCCCc1ccc(C2CCCN2C)cn1 CHEMBL103566
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
470 COCc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669806
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
471 Cc1ccc(C2CCCN2C)cn1 CHEMBL294757
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
472 C#Cc1cncc(C2CCCN2C)c1 CHEMBL111580
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
473 CCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1179042
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
474 CC(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1cccnc1OCC(N)=O CHEMBL3669838
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
475 CCc1ccc(C2CCCN2C)cn1 CHEMBL103225
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
476 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCC[n+]2cccc([C@@H]3CCCN3C)c2)c1 CHEMBL1179942
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
477 COc1ccnc(OC)c1C1CC(C)C(=O)N1Cc1cccc(-c2ncc(C)s2)c1 CHEMBL3986272
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
478 CN1CCCC1c1cncc(Cl)c1 CHEMBL61013
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
479 Cc1cc(-c2cccc(Cl)c2)ncc1C1CC(O)CN1C(=O)c1nccs1 CHEMBL1808896
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
480 CC(C)(O)Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1nccs1 CHEMBL1808887
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
481 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
482 COc1ccnc(OC)c1C1CC(C)C(=O)N1Cc1cccc(-c2csc(C)n2)c1 CHEMBL3958622
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
483 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCCNCC2CCc3ccc(O)cc3O2)c1 CHEMBL3614077
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
484 COc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)nc1 CHEMBL3669759
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
485 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)N(C)C)cc2)s1 CHEMBL3679833
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
486 COCCOc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)o2)cc1 CHEMBL3674875
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
487 Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)N3CC(O)C3)c2n1 CHEMBL3676060
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
488 COCCOc1ncccc1C1C(C(=O)C2CCCC2)C(=O)C(=O)N1c1ccc(-c2noc(C)n2)cc1 CHEMBL3679787
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
489 CCCCCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1179038
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
490 CN1C(=O)[C@H](OC2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)C[C@H]1c1cccnc1 CHEMBL3544598
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
491 COCCOCc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669811
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
492 CN1CC[C@@H]2CCc3cc[n+]([BH2-]C#N)cc3[C@@H]21 CHEMBL21553
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
493 O=C(NC1CCC[C@@H]1O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675994
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
494 CCN1C(=S)N2CCCC2c2c1nc(-c1ccc(OC)c(OC)c1)c(C#N)c2N1CCOCC1 CHEMBL3589379
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
495 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1cncnc1 CHEMBL1808877
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
496 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)Nc3cc(C4CC4)n[nH]3)c2n1 CHEMBL3676104
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
497 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)Nc3ccn(C(C)C)n3)c2n1 CHEMBL3676106
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
498 Cn1cccc1-c1cc(C(=O)N2CCCC2c2cccnc2)[nH]n1 CHEMBL3486928
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
499 CCC[n+]1cccc([C@@H]2CCCN2C)c1.[I-] CHEMBL560190
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
500 CN1CCCC1c1cnc2cc3ccncc3cc2c1 CHEMBL61883
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
501 CN1CCCC1c1cncc(Br)c1 CHEMBL61772
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
502 COCCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2csc(C)c2)cc1 CHEMBL3679830
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
503 Cc1ccc(-c2ccc(N3C(=O)C(=O)C(C(=O)CC(C)C)C3c3cccnc3C(=O)NN(C)C)cc2)s1 CHEMBL3679835
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
504 Cc1cncc([C@@H]2CCC[N+]2(C)[O-])c1 CHEMBL3640778
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
505 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC[C@@H](C)O)c2n1 CHEMBL3676028
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
506 CN1CCC[C@H]1c1ccc[n+](CCCCCNCC2CCc3ccc(O)cc3O2)c1 CHEMBL3614081
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
507 CN1C(=O)CC[C@H]1c1cccnc1.CN1C(=O)CC[C@H]1c1cccnc1.O=C(O)/C=C/C(=O)O CHEMBL3989573
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
508 COCCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679828
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
509 CN/C(=C1\C(=O)C(=O)N(c2ccc(-c3ccsc3)cc2)C1c1ccc[nH]c1=O)C(C)C CHEMBL3674777
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
510 CCN(C)C(=O)c1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679834
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
511 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)NC4CCC(O)CC4)c3n2)c1=O CHEMBL3937419
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
512 O=C1CC[C@]2(c3cccnc3)O[C@H](COc3ccc(Cl)cc3)CN12 CHEMBL343159
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
513 CCCCC#CCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-] CHEMBL559109
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
514 CCCCCCCCC[n+]1ccc2c(c1)[C@H]1[C@@H](CC2)CCN1C.[I-] CHEMBL52088
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
515 CN1CCC[C@H]1c1ccc[n+]([O-])c1 CHEMBL3126025
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
516 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)N[C@H](CO)C(C)(C)C)c3n2)c1=O CHEMBL3676095
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
517 C[N@@+]1(CC[N@@+]2(C)CCC[C@H]2c2cccnc2)CCC[C@@H]1c1cccnc1 CHEMBL1358826
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
518 Cc1cc(N(C)C)nc(N2CCCC2c2cccnc2)n1 CHEMBL3454403
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
519 c1cc2c(cn1)[C@H]1CCCN1CC2 CHEMBL3578315
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
520 CCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21.[I-] CHEMBL54225
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
521 O=C1[C@@H](NS(=O)(=O)c2ccc3cc(Cl)ccc3c2)CCCN1CC(=O)N1CCCC1c1cccnc1 CHEMBL1923459
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
522 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)Nc3ccc(=O)[nH]c3)c2n1 CHEMBL3676032
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
523 O=C(c1ccc(F)c(F)c1)N1CCN2C(=O)c3ccccc3[C@@]12c1ccc(N2CCC[C@H]2c2cccnc2)cc1 CHEMBL4100810
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
524 Cc1ncccc1C1CCCN1C CHEMBL160034
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
525 CN1CCCC1c1cnc2ccccc2c1 CHEMBL161944
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
526 C[C@@H](O)CNC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675984
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
527 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCC[n+]2cccc([C@H]3CCCN3C)c2)c1.[Br-].[Br-] CHEMBL551930
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
528 CCCCCCCCCC[n+]1cccc2c1CC[C@@H]1CCN(C)[C@H]21.[I-] CHEMBL441977
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
529 CCCc1cncc(C2CCCN2C)c1 CHEMBL382287
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
530 CC1=C(C(=O)N2CCCC2c2cccnc2)C(c2ccc(Cl)c(Cl)c2)n2nccc2N1 CHEMBL601248
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
531 CC(NC(=O)c1cnn2ccc(N3C(CO)CCC3c3cncc(F)c3)nc12)C(F)(F)F CHEMBL3676078
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
532 CN1C(=O)C[C@H](C(=O)O)[C@@H]1c1cccnc1 CHEMBL1715972
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
533 C#Cc1cncc([C@@H]2CCCN2C)c1.O=C(O)/C=C/C(=O)O CHEMBL2146093
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
534 COc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccoc2)cc1 CHEMBL3674856
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
535 Cc1cc(-c2cccc(Cl)c2)ncc1C1CCCN1C(=O)c1cnccn1 CHEMBL1808875
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
536 COC(=O)N1CC[C@@H]2C=Cc3cc(Cl)nc(Cl)c3[C@@H]21 CHEMBL374956
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
537 COCCOc1ncccc1C1C(C(=O)C(C)(C)C)C(=O)C(=O)N1c1ccc(-c2ccon2)cc1 CHEMBL3669786
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
538 OC(COc1ccccc1-c1nc2ccccc2o1)CN1CCCC1c1cccnc1 CHEMBL608832
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
539 O=C(Nc1ccccc1C(F)(F)F)N1CCCC1c1cccnc1 CHEMBL1353542
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
540 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCCCNC(=O)OC(C)(C)C)c2n1 CHEMBL3676015
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
541 COCCOc1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(SC)cc1 CHEMBL3679811
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
542 COCCOc1ncccc1[C@H]1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3674936
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
543 COCCN(C)C(=O)c1ncccc1C1C(C(=O)CC(C)C)C(=O)C(=O)N1c1ccc(-c2ccc(C)s2)cc1 CHEMBL3679840
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
544 CC(C)(C)C(=O)C1C(=O)C(=O)N(c2ccc(-c3ccco3)cc2)C1c1cccnc1OCCO CHEMBL3669815
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
545 CN1CCC[C@H]1c1cccnc1.O=C(O)C(O)C(O)C(=O)O CHEMBL1448280
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
546 CCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1189396
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
547 Cc1ccc2nc(CN3CCCC3c3cccnc3)cc(O)c2c1 CHEMBL3485916
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
548 CN1C(=O)CC[C@H]1c1cccnc1 CHEMBL578211
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
549 CN1C[C@@H](CF)C[C@H]1c1cccnc1 CHEMBL116706
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
550 Cc1nc(-c2ccc(N3C(=O)C(=O)C(C(=O)C(C)C)C3c3cccnc3N3CCOCC3)cc2)no1 CHEMBL3679788
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
551 CCCC/C=C/CC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197208
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
552 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)N3CC(O)C3)c2n1 CHEMBL3676013
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
553 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)Nc4cccnc4)c3n2)c1=O CHEMBL3676093
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
554 Cc1cc(C(=O)N2CCCC2c2cnc(-c3cccc(Cl)c3)cc2C)no1 CHEMBL1808874
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
555 CN1CCC[C@H]1c1ccc[n+](CCCCc2ccc(CCCC[n+]3cccc([C@@H]4CCCN4C)c3)cc2)c1 CHEMBL1182422
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
556 Cc1cc(C(=O)N2CCCC2c2ccc(-c3cccc(Cl)c3)nc2)no1 CHEMBL1808869
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
557 Cn1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)NC4CCC4)c3n2)c1=O CHEMBL3676092
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
558 CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCNCC2CCc3ccc(O)cc3O2)c1 CHEMBL3614076
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
559 CCCCC#CCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197029
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
560 CN1C[C@H](CO)C[C@H]1c1cccnc1 CHEMBL434607
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
561 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CCN(S(C)(=O)=O)CC3)c2n1 CHEMBL3676033
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
562 O=S(=O)(Nc1ncns1)c1ccc2c(N3CCCC3c3cccnc3)cccc2c1 CHEMBL3682681
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
563 CN1CCC[C@@]1(O)c1cccnc1 CHEMBL3544720
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
564 O=C(c1cc(-c2ccc(O)cc2)n[nH]1)N1CCCC1c1cccnc1 CHEMBL3474057
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
565 C[C@H](CO)NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675989
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
566 Cc1cc(-c2cc(C)c(C3CCCN3C(=O)c3cncs3)cn2)ccn1 CHEMBL1808894
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
567 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
568 COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1 CHEMBL3669812
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
569 CC(C)NC(=O)c1cnn2ccc(N3[C@@H](c4cncc(F)c4)CC[C@@]3(C)CO)nc12 CHEMBL3676084
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
570 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
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
571 C[C@H](NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12)C1CC1 CHEMBL3675998
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
572 C=CCCCCCCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197178
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
573 COCCNC(=O)[C@H]1C[C@@](CC(C)C)(C(=O)O)N(C)[C@H]1c1cccnc1 CHEMBL3475838
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
574 CCCC[n+]1cccc([C@@H]2CCCN2C)c1 CHEMBL1197114
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
575 CC(C)[C@H](CO)NC(=O)c1cnn2ccc(N3CCCC3c3cncc(F)c3)nc12 CHEMBL3675996
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
576 COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NCCCCO)c2n1 CHEMBL3676022
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
577 O=C(Nc1ccc(F)cn1)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12 CHEMBL3675970
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
bgruening
parents: 2
diff changeset
578 O=C(c1nccs1)N1CCCC1c1ccc(-c2cccc(Cl)c2)nc1 CHEMBL1808867
8b6ba267714b "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 515aded04abf81089ebecf6fc6841447bd519b2f"
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parents: 2
diff changeset
579 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