| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 7th, 2007 | 31 | Yes |
Popular Name: 7-(2-ethoxyethyl)-8-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-3-methyl-purine-2,6-dione 7-(2-ethoxyethyl)-8-[4-[(2-fluor…
| 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) | 1.24 | -3.03 | -49.34 | 2 | 9 | 1 | 90 | 431.492 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.24 | -2.75 | -112.73 | 3 | 9 | 2 | 90 | 432.5 | 7 | ↓ |
