UCSF

ZINC04164459

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 25 Yes

CAS Number: 57-24-9

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) 1.84 -1.2 -59.7 1 4 1 33 335.427 0

Activity (Go SEA)

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