| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2011 | 20 | Yes |
Popular Name: 2-(1,4-diazepan-1-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide 2-(1,4-diazepan-1-yl)-N-[2-(4-me…
| 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) | -0.56 | 1.68 | -82.82 | 4 | 6 | 2 | 53 | 285.436 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.56 | -0.7 | -39.6 | 3 | 6 | 1 | 52 | 284.428 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.56 | 1.01 | -82.57 | 4 | 6 | 2 | 57 | 285.436 | 5 | ↓ |
