| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 2008 | 37 | Yes |
Popular Name: 3,7-dibenzyl-1-[2-(3-chloro-4-methoxy-phenyl)-2-oxo-ethyl]purine-2,6-dione 3,7-dibenzyl-1-[2-(3-chloro-4-me…
| 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) | 5.06 | 16.67 | -22.15 | 0 | 8 | 0 | 88 | 514.969 | 8 | ↓ |
| Mid Mid (pH 6-8) | 5.06 | 17.18 | -64.05 | 1 | 8 | 1 | 89 | 515.977 | 8 | ↓ |
