| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2008 | 18 | Yes |
Popular Name: 1-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-1,4-diazepane 1-[(1R)-1-(1,3-benzodioxol-5-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) | 1.76 | 4.72 | -34.81 | 2 | 4 | 1 | 35 | 249.334 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.76 | 4.06 | -43.29 | 2 | 4 | 1 | 38 | 249.334 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.76 | 6 | -122.31 | 3 | 4 | 2 | 40 | 250.342 | 2 | ↓ |
