| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 20 | Yes |
Popular Name: 6-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-oxo-1H-pyridine-3-carbonitrile 6-(3,4-dihydro-2H-1,5-benzodioxe…
| 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) | 1.74 | 5.32 | -18.15 | 1 | 5 | 0 | 75 | 268.272 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 3.49 | -51.89 | 0 | 5 | -1 | 78 | 267.264 | 1 | ↓ |
