UCSF

ZINC08681596

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2007 20 No

CAS Number: 895-23-8

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) 1.45 -1.51 -12.3 4 5 0 90 274.272 1

Activity (Go SEA)

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