In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2006 | 28 | Yes |
Popular Name: 7-[(4-chlorophenyl)methyl]-8-(3,5-dimethylpyrazol-1-yl)-1,3-dimethyl-purine-2,6-dione 7-[(4-chlorophenyl)methyl]-8-(3,…
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) | 3.25 | 2.64 | -8.51 | 0 | 8 | 0 | 79 | 398.854 | 3 | ↓ |