| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2009 | 33 | No |
Popular Name: 1-isopentyl-7-[(3-nitrophenyl)methyl]-3-(p-tolyl)purine-2,6-dione 1-isopentyl-7-[(3-nitrophenyl)me…
| 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) | 4.97 | 16.6 | -15.39 | 0 | 9 | 0 | 108 | 447.495 | 7 | ↓ |
