UCSF

ZINC00967164

Substance Information

In ZINC since Heavy atoms Benign functionality
August 5th, 2004 17 Yes

CAS Number: 17075-03-5

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) 4.29 -0.36 -8.73 2 1 0 26 217.271 0

Activity (Go SEA)

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