UCSF

ZINC34660324

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 21 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) 0.20 3.7 -81.59 5 9 1 144 297.291 7
Hi High (pH 8-9.5) 0.20 2.34 -34.97 4 9 0 139 296.283 7

Activity (Go SEA)

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