UCSF

ZINC67490165

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2011 25 Yes

Popular Name: 5-[1-[[6-(trifluoromethyl)-3-pyridyl]methyl]imidazol-2-yl]-2,1,3-benzoxadiazole 5-[1-[[6-(trifluoromethyl)-3-pyr…

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) 3.37 7.49 -13.87 0 6 0 70 345.284 4 ↓
Mid Mid (pH 6-8) 3.37 8.06 -53.24 1 6 1 71 346.292 4 ↓

Activity (Go SEA)

Rings

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

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