| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 16 | Yes |
Popular Name: [2-(4-methyl-1,4-diazepan-1-yl)-4-pyridyl]methanamine [2-(4-methyl-1,4-diazepan-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) | 0.44 | 4.05 | -97.64 | 4 | 4 | 2 | 48 | 222.336 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.44 | 3.67 | -37.19 | 3 | 4 | 1 | 47 | 221.328 | 2 | ↓ |
