| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 6th, 2006 | 24 | Yes |
Popular Name: 7-[2-(4-chlorophenyl)-1-methyl-2-oxo-ethyl]-1,3-dimethyl-purine-2,6-dione 7-[2-(4-chlorophenyl)-1-methyl-2…
| 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) | 2.25 | 9.24 | -9.99 | 0 | 7 | 0 | 79 | 346.774 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 9.73 | -42.19 | 1 | 7 | 1 | 80 | 347.782 | 3 | ↓ |
