UCSF

ZINC69740823

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 25 Yes

Popular Name: 3-[(4-fluoro-1H-benzimidazol-2-yl)methyl]benzofuro[3,2-d]pyrimidin-4-one 3-[(4-fluoro-1H-benzimidazol-2-y…

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) 2.79 8.47 -32.83 1 6 0 77 334.31 2 ↓
Lo Low (pH 4.5-6) 2.79 9.19 -44.74 2 6 1 78 335.318 2 ↓

Activity (Go SEA)

Rings

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

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