| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 18 | Yes |
Popular Name: 2-[1,4]Diazepan-1-yl-1-(2,6-dimethyl-morpholin-4-yl)-ethanone 2-[1,4]Diazepan-1-yl-1-(2,6-dime…
| 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) | -0.17 | 3.14 | -40.65 | 2 | 5 | 1 | 46 | 256.37 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.17 | 1.28 | -8.16 | 1 | 5 | 0 | 45 | 255.362 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.17 | 2.48 | -44.2 | 2 | 5 | 1 | 49 | 256.37 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.17 | 4.44 | -118.38 | 3 | 5 | 2 | 51 | 257.378 | 2 | ↓ |
