UCSF

ZINC06189425

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2006 10 Yes

CAS Numbers: 768-18-3 , N/A

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) 2.41 2.44 -5.13 0 1 0 4 131.178 0

Activity (Go SEA)

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