| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 5th, 2008 | 29 | Yes |
Popular Name: 8-(3,5-dimethylpyrazol-1-yl)-1-ethyl-3-methyl-7-(m-tolylmethyl)purine-2,6-dione 8-(3,5-dimethylpyrazol-1-yl)-1-e…
| 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) | 3.37 | 3.41 | -9.59 | 0 | 8 | 0 | 80 | 392.463 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.37 | 3.6 | -31.31 | 1 | 8 | 1 | 81 | 393.471 | 4 | ↓ |
