UCSF

ZINC20212027

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 33 Yes

Popular Name: 2-[(3R)-7-chloro-2-oxo-5-phenyl-3-sec-butyl-3H-1,4-benzodiazepin-1-yl]-N-[[(2S)-tetrahydrofuran-2-yl 2-[(3R)-7-chloro-2-oxo-5-phenyl-…

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Download: MOL2 SDF SMILES Flexibase

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) 4.33 8.92 -12.21 1 6 0 71 467.997 7 ↓
Lo Low (pH 4.5-6) 4.33 9.68 -34.98 2 6 1 73 469.005 7 ↓

Activity (Go SEA)

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