UCSF

ZINC41664163

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 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) 0.00 3.99 -15.96 0 3 0 44 152.197 1

Activity (Go SEA)

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