| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 16 | Yes |
Popular Name: [2-(4-methyl-1,4-diazepan-1-yl)-3-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 | 4.49 | -96.77 | 4 | 4 | 2 | 48 | 222.336 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.44 | 4.92 | -181.9 | 5 | 4 | 3 | 49 | 223.344 | 2 | ↓ |
