UCSF

ZINC02002433

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 16 Yes

CAS Number: 56391-55-0

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) 1.35 -1.27 -9.71 0 3 0 29 217.268 1

Activity (Go SEA)

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