UCSF

ZINC38403544

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 21st, 2010 36 Yes

Popular Name: (2R)-2-[[2-(3,5-difluorophenyl)acetyl]amino]-N-[(3S)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3- (2R)-2-[[2-(3,5-difluorophenyl)a…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.66 8.51 -16.46 2 7 0 91 490.51 6 ↓
Lo Low (pH 4.5-6) 2.66 9.41 -37.93 3 7 1 92 491.518 6 ↓

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )