| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2008 | 18 | No |
Popular Name: (4S)-4-(3-bromophenyl)-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepin-7-one (4S)-4-(3-bromophenyl)-4,8-dihyd…
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) | 2.46 | 3.25 | -10.02 | 2 | 4 | 0 | 61 | 324.203 | 1 | ↓ |
| Ref Reference (pH 7) | 2.27 | 5.73 | -9.93 | 2 | 4 | 0 | 58 | 324.203 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 3.2 | -42.87 | 0 | 4 | -1 | 60 | 323.195 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.27 | 5.71 | -8.12 | 2 | 4 | 0 | 58 | 324.203 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.46 | 3.27 | -7.6 | 2 | 4 | 0 | 61 | 324.203 | 1 | ↓ |
