| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 33 | Yes |
Popular Name: 3-butyl-1-[(3R)-6-(dipropylamino)-3-hydroxy-3-methyl-hex-4-ynyl]-7-propyl-purine-2,6-dione 3-butyl-1-[(3R)-6-(dipropylamino…
| 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) | 4.84 | 14.44 | -41.52 | 2 | 8 | 1 | 87 | 460.643 | 13 | ↓ |
| Hi High (pH 8-9.5) | 4.84 | 12.32 | -12 | 1 | 8 | 0 | 85 | 459.635 | 13 | ↓ |
