In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 24th, 2008 | 31 | Yes |
Popular Name: 6-(3-methoxypropyl)-2,4-dimethyl-7-(2-naphthyl)purino[7,8-a]imidazole-1,3-dione 6-(3-methoxypropyl)-2,4-dimethyl…
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) | 3.54 | 14.12 | -13.61 | 0 | 8 | 0 | 75 | 417.469 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.54 | 14.59 | -38.76 | 1 | 8 | 1 | 77 | 418.477 | 5 | ↓ |