UCSF

ZINC06793659

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2006 20 Yes

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) 0.08 1.07 -16.83 2 7 0 101 295.32 6
Lo Low (pH 4.5-6) 0.08 1.35 -48.52 3 7 1 102 296.328 6

Activity (Go SEA)

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