| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2008 | 19 | No |
Popular Name: (4S)-4-(2,4-difluorophenyl)-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepin-7-one (4S)-4-(2,4-difluorophenyl)-4,8-…
None
| 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) | 1.93 | 2.63 | -8.3 | 2 | 4 | 0 | 61 | 281.287 | 1 | ↓ |
| Ref Reference (pH 7) | 1.74 | 5.09 | -7.78 | 2 | 4 | 0 | 58 | 281.287 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.82 | 2.83 | -42.77 | 0 | 4 | -1 | 60 | 280.279 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.74 | 5.06 | -6.58 | 2 | 4 | 0 | 58 | 281.287 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.93 | 2.64 | -6.44 | 2 | 4 | 0 | 61 | 281.287 | 1 | ↓ |
