| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 20 | Yes |
Popular Name: 2,4-dioxo-N-[(1-propylpyrazol-4-yl)methyl]-1H-pyrimidine-6-carboxamide 2,4-dioxo-N-[(1-propylpyrazol-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) | -0.59 | 0.22 | -13.19 | 3 | 8 | 0 | 113 | 277.284 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.14 | -1.54 | -37.04 | 2 | 8 | -1 | 116 | 276.276 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.14 | -2.53 | -47.81 | 2 | 8 | -1 | 116 | 276.276 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
