| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2008 | 27 | Yes |
Popular Name: 3-butyl-8-(3-fluorophenyl)-7-pentyl-purine-2,6-dione 3-butyl-8-(3-fluorophenyl)-7-pen…
| 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 | 10.92 | -7.84 | 1 | 6 | 0 | 73 | 372.444 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.68 | 11.36 | -38.03 | 2 | 6 | 1 | 74 | 373.452 | 8 | ↓ |
