UCSF

ZINC04429288

Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2005 22 No

CAS Number: 472-54-8

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) 3.56 2.15 -9.25 0 2 0 34 300.442 1

Activity (Go SEA)

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