UCSF

ZINC34025313

Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2009 36 No

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) 6.45 16.43 -37.57 1 4 1 32 484.66 7
Hi High (pH 8-9.5) 6.45 14.08 -8.11 0 4 0 31 483.652 7

Activity (Go SEA)

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