UCSF

ZINC53517018

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2010 27 Yes

Popular Name: 4-methyl-N-[3-[2-(1-piperidyl)ethyl]-1H-benzimidazol-3-ium-2-yl]benzamide 4-methyl-N-[3-[2-(1-piperidyl)et…

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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) 4.27 13.85 -47.2 2 5 1 55 363.485 4 ↓
Hi High (pH 8-9.5) 4.27 11.63 -10.53 1 5 0 53 362.477 4 ↓

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

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