UCSF

ZINC05751646

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2006 22 Yes

Popular Name: (R-(R*,S*))-1,3-Dihydro-7-chloro-3-(1-hydroxyethyl)-5-phenyl-2H-1,4-benzodiazepin-2-one; 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(1-hydroxyethyl)-5-phenyl-, (R-(R*,S*))-; BRN 0682392; LS-34233 (R-(R*,S*))-1,3-Dihydro-7-chloro…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.21 3.18 -10.35 2 4 0 62 314.772 2 ↓
Hi High (pH 8-9.5) 2.40 1.23 -51 1 4 -1 68 313.764 2 ↓

Activity (Go SEA)

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