| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2010 | 16 | Yes |
Popular Name: 4-[[2-(aminomethyl)imidazol-1-yl]methyl]benzonitrile 4-[[2-(aminomethyl)imidazol-1-yl…
| 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) | 0.63 | 5.02 | -59.01 | 3 | 4 | 1 | 69 | 213.264 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.63 | 5.53 | -130.56 | 4 | 4 | 2 | 71 | 214.272 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.63 | 4.89 | -10.87 | 2 | 4 | 0 | 68 | 212.256 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.63 | 5.71 | -37.86 | 3 | 4 | 1 | 69 | 213.264 | 3 | ↓ |
