| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 21 | Yes |
Popular Name: 4-[[2-(cyanomethyl)benzimidazol-1-yl]methyl]pyridine-2-carbonitrile 4-[[2-(cyanomethyl)benzimidazol-…
| 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) | 2.08 | 8.25 | -19.11 | 0 | 5 | 0 | 78 | 273.299 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.08 | 8.68 | -48.81 | 1 | 5 | 1 | 80 | 274.307 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
