| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 14th, 2008 | 31 | Yes |
Popular Name: 1-ethyl-7-methyl-3-[4-(9H-purin-6-yl)piperazine-1-carbonyl]-1,8-naphthyridin-4-one 1-ethyl-7-methyl-3-[4-(9H-purin-…
| 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) | 0.61 | -2.94 | -29.9 | 1 | 10 | 0 | 113 | 418.461 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.61 | -2.99 | -34.44 | 1 | 10 | 0 | 113 | 418.461 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.61 | 10.95 | -47.44 | 2 | 10 | 1 | 114 | 419.469 | 3 | ↓ |
