In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 29th, 2008 | 23 | Yes |
Popular Name: 1-[(8S)-8-hydroxynonyl]-3,7-dimethyl-purine-2,6-dione 1-[(8S)-8-hydroxynonyl]-3,7-dime…
None
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) | 2.36 | 8.05 | -13.12 | 1 | 7 | 0 | 82 | 322.409 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.36 | 8.54 | -48.34 | 2 | 7 | 1 | 83 | 323.417 | 8 | ↓ |