| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2010 | 20 | Yes |
Popular Name: N-(1-methylpyrazol-3-yl)-4-oxo-1H-quinoline-2-carboxamide N-(1-methylpyrazol-3-yl)-4-oxo-1…
| 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) | 0.57 | 5.03 | -14.26 | 2 | 6 | 0 | 80 | 268.276 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 3.68 | -51.07 | 1 | 6 | -1 | 83 | 267.268 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
