UCSF

ZINC02032619

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2004 8 Yes

CAS Number: 624-22-6

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) 2.37 -0.66 -2.24 1 1 0 20 116.204 4

Activity (Go SEA)

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