| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 22 | Yes |
Popular Name: 4-[[[(1R)-1-(5-chloro-1H-benzimidazol-2-yl)ethyl]amino]methyl]benzonitrile 4-[[[(1R)-1-(5-chloro-1H-benzimi…
| 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) | 3.46 | 7.25 | -12.27 | 2 | 4 | 0 | 65 | 310.788 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.46 | 8.44 | -57.95 | 3 | 4 | 1 | 69 | 311.796 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.46 | 7.66 | -38.38 | 3 | 4 | 1 | 66 | 311.796 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
