| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2008 | 28 | No |
Popular Name: 7-[(E)-3-chlorobut-2-enyl]-1,3-dimethyl-8-(3-morpholinopropylamino)purine-2,6-dione 7-[(E)-3-chlorobut-2-enyl]-1,3-d…
| 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) | 1.62 | 8.23 | -14.47 | 1 | 9 | 0 | 86 | 410.906 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.62 | -1.06 | -111.6 | 3 | 9 | 2 | 89 | 412.922 | 7 | ↓ |
