| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2004 | 20 | Yes |
Popular Name: 9-[(2S,3S,4R,5S)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]xanthine 9-[(2S,3S,4R,5S)-3,4-dihydroxy-5…
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| 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) | -1.72 | -8.98 | -51.72 | 4 | 10 | -1 | 157 | 283.22 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -2.18 | -6.95 | -17.23 | 5 | 10 | 0 | 153 | 284.228 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0196530A2; EP0365556A1; EP0365556B1; EP0475443A2; EP0475443B1; EP0570519A1; EP0570519B1; EP0629705B1; EP0661291A1; EP0673783A2; EP0673783A3; EP0673783B1; EP0743573A3; EP0743573B1; EP0743574A3; EP0743574B1; EP0771204A1; US5514505; US5563014; US5659348; U | IBM Patent Data |
