UCSF

ZINC05346706

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2006 18 Yes

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) 3.59 -0.76 -12.38 2 3 0 52 261.708 4

Activity (Go SEA)

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