| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2008 | 23 | No |
Popular Name: (4S)-4-(2,3,4-trimethoxyphenyl)-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepin-7-one (4S)-4-(2,3,4-trimethoxyphenyl)-…
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) | 1.50 | 1.58 | -10.87 | 2 | 7 | 0 | 89 | 335.385 | 4 | ↓ |
| Ref Reference (pH 7) | 1.32 | 4.05 | -10.31 | 2 | 7 | 0 | 85 | 335.385 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.40 | 2.09 | -47.98 | 0 | 7 | -1 | 88 | 334.377 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.32 | 4.01 | -9.25 | 2 | 7 | 0 | 85 | 335.385 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.50 | 1.58 | -8.99 | 2 | 7 | 0 | 89 | 335.385 | 4 | ↓ |
