UCSF

ZINC69929004

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 25 Yes

Popular Name: N-(2-dimethylaminoethyl)-1,2-dimethyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzimidazole-5-carboxami N-(2-dimethylaminoethyl)-1,2-dim…

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) 0.93 9.02 -47.59 1 6 1 52 345.467 6 ↓
Lo Low (pH 4.5-6) 0.93 9.5 -96.88 2 6 2 53 346.475 6 ↓

Activity (Go SEA)

Rings

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

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