UCSF

ZINC26522838

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 32 Yes

CAS Number: 2579-08-0

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) 8.12 18.26 -5.29 0 2 0 26 438.696 7

Activity (Go SEA)

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