UCSF

ZINC66066630

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 18th, 2011 22 Yes

Popular Name: 2-(3H-benzimidazol-5-yl)-3H-benzo[e]benzimidazole 2-(3H-benzimidazol-5-yl)-3H-benz…

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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) 4.17 8.98 -13.38 2 4 0 57 284.322 1 ↓
Lo Low (pH 4.5-6) 4.17 9.87 -87.57 4 4 2 60 286.338 1 ↓
Lo Low (pH 4.5-6) 4.17 9.4 -33.72 3 4 1 59 285.33 1 ↓

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

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