| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2008 | 24 | No |
Popular Name: (4S)-4-(3-phenoxyphenyl)-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepin-7-one (4S)-4-(3-phenoxyphenyl)-4,8-dih…
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) | 3.40 | 5.54 | -10.38 | 2 | 5 | 0 | 71 | 337.404 | 3 | ↓ |
| Ref Reference (pH 7) | 3.22 | 8.01 | -10.46 | 2 | 5 | 0 | 67 | 337.404 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.30 | 5.45 | -44.81 | 0 | 5 | -1 | 69 | 336.396 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.22 | 8 | -8.4 | 2 | 5 | 0 | 67 | 337.404 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 5.56 | -7.64 | 2 | 5 | 0 | 71 | 337.404 | 3 | ↓ |
