In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2009 | 31 | Yes |
Popular Name: 1-isobutyl-7-[(2-methoxyphenyl)methyl]-3-(o-tolyl)purine-2,6-dione 1-isobutyl-7-[(2-methoxyphenyl)m…
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) | 4.68 | 14.44 | -11.55 | 0 | 7 | 0 | 71 | 418.497 | 6 | ↓ |