UCSF

ZINC52227869

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2010 16 No

Popular Name: 4-[(2R)-2-bromo-3-cyclopropyl-3-oxo-propyl]benzonitrile 4-[(2R)-2-bromo-3-cyclopropyl-3-…

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) 2.63 8.94 -7.52 0 2 0 41 278.149 4 ↓

Activity (Go SEA)

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