| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 31st, 2006 | 12 | Yes |
Popular Name: 7-methyl xanthine 7-methyl xanthine
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CAS Number: 552-62-5
| 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) | -0.82 | -2.58 | -15.85 | 3 | 6 | 0 | 81 | 168.156 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.