In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2008 | 33 | Yes |
Popular Name: 1,3-dimethyl-7-(p-tolylmethyl)-8-(4-pyrimidin-2-ylpiperazin-1-yl)purine-2,6-dione 1,3-dimethyl-7-(p-tolylmethyl)-8…
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) | 2.83 | 12.28 | -12.18 | 0 | 10 | 0 | 94 | 446.515 | 4 | ↓ |