| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 20th, 2013 | 32 | Yes |
Popular Name: Ethyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate Ethyl 1-((2'-cyano-[1,1'-bipheny…
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CAS Number: [139481-41-7]
'Ethyl 1-((2''-cyano-[1,1''-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate'
1H-Benzimidazole-7-carboxylic acid,1-((2'-cyano(1,1'-biphenyl)-4-yl)methyl)-2-ethoxy-ethylester
| 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) | 4.87 | 14.33 | -23.92 | 1 | 6 | 0 | 88 | 425.488 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.87 | 14.29 | -16.17 | 1 | 6 | 0 | 88 | 425.488 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.87 | 14.76 | -39.82 | 2 | 6 | 1 | 89 | 426.496 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.