| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 5th, 2008 | 25 | Yes |
Popular Name: 2-[3,7-dimethyl-2,6-dioxo-8-(3,4,5-trimethylpyrazol-1-yl)purin-1-yl]acetamide 2-[3,7-dimethyl-2,6-dioxo-8-(3,4…
| 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) | 0.08 | 0.07 | -16.6 | 2 | 10 | 0 | 123 | 345.363 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.08 | 0.26 | -36.77 | 3 | 10 | 1 | 124 | 346.371 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
