| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 21 | No |
Popular Name: 2-(1,4-diazepan-1-yl)-N-(2-dimethylaminoethyl)-N-isobutyl-2-oxo-acetamide 2-(1,4-diazepan-1-yl)-N-(2-dimet…
| 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) | -0.27 | 6.31 | -105.23 | 3 | 6 | 2 | 62 | 300.447 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.27 | 5.56 | -34.35 | 2 | 6 | 1 | 57 | 299.439 | 6 | ↓ |
