| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2008 | 23 | No |
Popular Name: (4S)-4-[4-(cyclopentoxy)phenyl]-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepin-7-one (4S)-4-[4-(cyclopentoxy)phenyl]-…
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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) | 3.13 | 4.82 | -9.75 | 2 | 5 | 0 | 71 | 329.425 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.02 | 4.76 | -49.54 | 0 | 5 | -1 | 69 | 328.417 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.94 | 7.27 | -8.02 | 2 | 5 | 0 | 67 | 329.425 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | 4.84 | -7.46 | 2 | 5 | 0 | 71 | 329.425 | 3 | ↓ |
