UCSF

ZINC67955774

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 24 Yes

Popular Name: N-[(5-chloro-1H-benzimidazol-2-yl)methyl]-N,1-dimethyl-imidazo[2,1-e]pyrazole-7-carboxamide N-[(5-chloro-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) 1.10 7.78 -21.38 1 7 0 71 342.79 3 ↓
Lo Low (pH 4.5-6) 1.10 8.57 -39.26 2 7 1 72 343.798 3 ↓

Activity (Go SEA)

Rings

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

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