| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2008 | 20 | No |
Popular Name: (4R)-4-(2-nitrophenyl)-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepin-7-one (4R)-4-(2-nitrophenyl)-4,8-dihyd…
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| 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) | 1.40 | 5.27 | -11.15 | 2 | 7 | 0 | 104 | 290.304 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.48 | 3.17 | -52.19 | 0 | 7 | -1 | 106 | 289.296 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 5.24 | -10.58 | 2 | 7 | 0 | 104 | 290.304 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.58 | 2.81 | -11.14 | 2 | 7 | 0 | 107 | 290.304 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.58 | 2.8 | -12.42 | 2 | 7 | 0 | 107 | 290.304 | 2 | ↓ |
