| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 31st, 2006 | 25 | Yes |
Popular Name: 3,7-dimethyl-8-(3-methyl-5-phenyl-pyrazol-1-yl)-purine-2,6-dione 3,7-dimethyl-8-(3-methyl-5-pheny…
| 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) | 1.41 | 10.23 | -10 | 1 | 8 | 0 | 91 | 336.355 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.41 | 10.39 | -27.59 | 2 | 8 | 1 | 92 | 337.363 | 2 | ↓ |
