| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 19th, 2009 | 33 | Yes |
Popular Name: 7-[(2S)-2-hydroxy-3-[4-(3-phenoxypropyl)piperazin-1-yl]propyl]-1,3-dimethyl-purine-2,6-dione 7-[(2S)-2-hydroxy-3-[4-(3-phenox…
| 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) | 1.29 | 8.55 | -50.1 | 2 | 10 | 1 | 99 | 457.555 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.29 | 6.23 | -13.62 | 1 | 10 | 0 | 98 | 456.547 | 9 | ↓ |
