In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 1st, 2011 | 32 | Yes |
Popular Name: Ethyl 2-ethoxy-1-[[(2'-cyanobiphenyl-4-yl)methyl]benzimidazole]-7-carboxylate Ethyl 2-ethoxy-1-[[(2'-cyanobiph…
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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
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) | 5.74 | 13.02 | -61.07 | 0 | 6 | -1 | 91 | 424.48 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.74 | 14.04 | -52.31 | 1 | 6 | 0 | 92 | 425.488 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.