| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 2nd, 2011 | 26 | Yes |
Popular Name: 3-butyl-8-[(4-ethylanilino)methyl]-7-methyl-purine-2,6-dione 3-butyl-8-[(4-ethylanilino)methy…
| 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) | 2.76 | 8.26 | -8.88 | 2 | 7 | 0 | 85 | 355.442 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
