| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 27th, 2008 | 33 | Yes |
Popular Name: 7-[4-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-4-oxo-butyl]-1,3-dimethyl-purine-2,6-dione 7-[4-[4-(1,3-benzothiazol-2-yl)-…
| 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) | 2.12 | 12.04 | -25.13 | 0 | 9 | 0 | 95 | 466.567 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.12 | 12.53 | -61.82 | 1 | 9 | 1 | 96 | 467.575 | 5 | ↓ |
