UCSF

ZINC24081445

Substance Information

In ZINC since Heavy atoms Benign functionality
January 13th, 2009 34 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) 3.59 11.95 -75.08 1 7 0 77 463.578 10
Hi High (pH 8-9.5) 3.59 9.42 -60.72 0 7 -1 76 462.57 10

Activity (Go SEA)

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