UCSF

ZINC05190679

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 25th, 2006 29 No

Popular Name: 11-(2-chloro-6-fluorophenyl)-3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepine-7-carboxylic acid 11-(2-chloro-6-fluorophenyl)-3,3…

Find On: PubMed — Wikipedia — Google

CAS Number: 946386-64-7

Other Names:

MFCD00170250

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) 4.98 -0.18 -51.71 2 5 -1 81 413.856 2 ↓

Activity (Go SEA)

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