UCSF

ZINC49544482

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 28 Yes

Popular Name: (7R)-7-(2,4-difluorophenyl)-3-(2,5-dimethoxyphenyl)-6,7-dihydro-4H-imidazo[4,5-b]pyridin-5-one (7R)-7-(2,4-difluorophenyl)-3-(2…

Find On: PubMed — Wikipedia — Google

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) 3.41 6.54 -11.8 1 6 0 69 385.37 4 ↓
Ref Reference (pH 7) 3.23 9.19 -10.42 1 6 0 65 385.37 4 ↓
Lo Low (pH 4.5-6) 3.23 9.65 -37.74 2 6 1 67 386.378 4 ↓

Activity (Go SEA)

Rings

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

No pre-computed analogs available. Try a structural similarity search.