| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 28th, 2006 | 29 | Yes |
Popular Name: 7-[3-(3,4-dimethylphenoxy)-2-hydroxy-propyl]-3-methyl-8-propylamino-purine-2,6-dione 7-[3-(3,4-dimethylphenoxy)-2-hyd…
| 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) | 1.97 | 7.2 | -15.57 | 3 | 9 | 0 | 114 | 401.467 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.97 | 7.62 | -43.9 | 4 | 9 | 1 | 115 | 402.475 | 8 | ↓ |
