In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 12th, 2008 | 16 | Yes |
Popular Name: 1,3-Diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione 1,3-Diethyl-7-methyl-1H-purine-2…
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CAS Number: 54965-57-0
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) | 0.82 | 6.84 | -11.18 | 0 | 6 | 0 | 62 | 222.248 | 2 | ↓ |