UCSF

ZINC16082927

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2008 20 Yes

Popular Name: (3R)-3-amino-5-bromo-1-[(4-fluorophenyl)methyl]indolin-2-one (3R)-3-amino-5-bromo-1-[(4-fluor…

Find On: PubMed — Wikipedia — Google

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) 1.01 6.4 -6.96 2 3 0 46 335.176 2 ↓
Lo Low (pH 4.5-6) 1.01 6.72 -48.82 3 3 1 48 336.184 2 ↓
Lo Low (pH 4.5-6) 1.01 6.71 -47.3 3 3 1 48 336.184 2 ↓

Activity (Go SEA)

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