| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 19 | Yes |
Popular Name: 1-(1,4-diazepan-1-yl)-2-[methyl(4-pyridylmethyl)amino]ethanone 1-(1,4-diazepan-1-yl)-2-[methyl(…
| 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 | 5.9 | -106.19 | 3 | 5 | 2 | 54 | 264.373 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.63 | 3.64 | -48.95 | 2 | 5 | 1 | 53 | 263.365 | 4 | ↓ |
