UCSF

ZINC17105025

Substance Information

In ZINC since Heavy atoms Benign functionality
September 15th, 2008 11 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) -0.80 1.53 -90.83 1 9 -2 118 151.093 2

Activity (Go SEA)

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