UCSF

ZINC33928335

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2009 32 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) 3.32 8.07 -32.3 4 11 1 142 507.348 6
Hi High (pH 8-9.5) 3.32 5.96 -9.11 3 11 0 140 506.34 6

Activity (Go SEA)

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