UCSF

ZINC06352285

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2006 22 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) 2.49 -6.62 -16.53 1 5 0 80 339.438 5
Hi High (pH 8-9.5) 2.49 -6.05 -48.47 0 5 -1 82 338.43 5

Activity (Go SEA)

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