UCSF

ZINC35752092

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2009 15 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) 0.72 3.91 -39.78 2 4 0 65 215.293 5

Activity (Go SEA)

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