| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2008 | 20 | No |
Popular Name: (4S)-4-(1,3-benzodioxol-5-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-one (4S)-4-(1,3-benzodioxol-5-yl)-4,…
| 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) | 1.38 | 3.74 | -9.07 | 2 | 6 | 0 | 76 | 289.316 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.55 | 2.85 | -44.82 | 1 | 6 | -1 | 78 | 288.308 | 1 | ↓ |
