| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 27 | Yes |
Popular Name: 3-butyl-8-[(2-isopropylanilino)methyl]-7-methyl-purine-2,6-dione 3-butyl-8-[(2-isopropylanilino)m…
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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) | 2.84 | 8.86 | -8.61 | 2 | 7 | 0 | 85 | 369.469 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
