| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 19th, 2009 | 32 | Yes |
Popular Name: 7-[(2S)-2-hydroxy-3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]-1,3-dimethyl-purine-2,6-dione 7-[(2S)-2-hydroxy-3-[4-(2-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) | 1.02 | 7.96 | -46.58 | 2 | 10 | 1 | 99 | 443.528 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.02 | 5.59 | -13.84 | 1 | 10 | 0 | 98 | 442.52 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.02 | 7.92 | -52.14 | 2 | 10 | 1 | 99 | 443.528 | 8 | ↓ |
