UCSF

ZINC42470249

Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2010 10 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) 0.84 2.7 -35.91 2 2 1 25 209.107 2
Hi High (pH 8-9.5) 0.84 0.46 -2.9 1 2 0 23 208.099 2

Activity (Go SEA)

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