In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 1st, 2006 | 30 | Yes |
Popular Name: 3-(2-methylphenyl)-1-[4-(trifluoromethoxy)benzyl]-3,7-dihydro-1H-purine-2,6-dione 3-(2-methylphenyl)-1-[4-(trifluo…
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) | 4.45 | 11.33 | -13.17 | 1 | 7 | 0 | 82 | 416.359 | 5 | ↓ |