| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 12 | Yes |
Popular Name: 9-Methylxanthine 9-Methylxanthine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1198-33-0 , [1198-33-0]
| 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) | -1.02 | -2.47 | -16.15 | 2 | 6 | 0 | 83 | 166.14 | 0 | ↓ |
