UCSF

ZINC06535097

Substance Information

In ZINC since Heavy atoms Benign functionality
April 6th, 2006 26 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) 1.10 2.37 -70.16 8 8 2 134 360.414 11
Hi High (pH 8-9.5) 1.10 3.4 -50.99 7 8 1 137 359.406 11

Activity (Go SEA)

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