UCSF

ZINC34687897

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 12 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) -0.40 2.06 -7.69 1 3 0 47 168.192 0

Activity (Go SEA)

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