Mercurial > repos > bgruening > silicos_it
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author | bgruening |
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date | Sun, 20 Apr 2014 09:03:37 -0400 |
parents | bb92d30b4f52 |
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MW ALOGP HBA HBD PSA ROTB AROM ALERTS QED NAME 286.34 1.092 6 3 101.88 4 2 1 0.713 Abacavir 181.21 0.481 4 2 83.47 5 0 2 0.589 Acamprosate 336.43 2.365 5 3 87.66 11 1 1 0.599 Acebutolol 151.16 1.351 2 2 49.33 2 1 1 0.716 Acetaminophen 222.25 0.225 5 2 115.04 3 1 1 0.708 Acetazolamide 324.40 3.291 4 2 92.34 6 1 1 0.796 Acetohexamide 411.57 3.492 6 1 47.02 7 2 1 0.711 Acetophenazine 329.37 3.327 4 1 39.72 4 2 0 0.919 Paroxetine 270.21 3.146 3 1 55.13 4 2 0 0.937 Leflunomide 312.42 2.318 3 1 50.16 3 2 0 0.965 Granisetron 314.50 3.789 2 1 19.03 4 2 0 0.857 Pergolide 276.38 1.481 3 1 45.33 3 1 0 0.936 Molindone 561.55 6.476 6 2 118.77 23 1 5 0.111 ChloramphenicalPalmitate 663.41 6.279 8 3 108.33 24 0 3 0.101 ClindamycinPalmitate 610.67 5.837 10 1 143.34 13 5 2 0.116 CandesartanCilexetil 315.87 5.079 2 0 3.24 3 3 0 0.559 Chlorprothixene 366.84 5.505 3 1 54.37 2 2 0 0.759 Atovaquone 314.86 4.528 2 0 6.48 4 2 0 0.707 Clomipramine 309.48 5.015 2 0 3.24 2 2 0 0.651 Methixene 312.48 5.020 3 0 6.48 5 2 0 0.669 Ethopropazine 337.46 0.371 6 5 173.33 8 1 3 0.299 Famotidine 252.35 -0.036 5 3 88.89 7 1 5 0.375 Cimetidine 301.39 1.664 3 5 96.29 9 2 4 0.360 Tegaserod 395.42 -0.172 8 4 158.21 6 1 4 0.267 Cefdinir 494.57 2.496 7 2 113.01 8 2 4 0.357 CarbenicillinIndanyl