| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 18th, 2008 | 29 | No |
Popular Name: 4-hydroxy-1-methyl-3-[(4Z)-4-[(2-nitrophenyl)methylene]-5-oxo-1H-pyrazol-3-yl]quinolin-2-one 4-hydroxy-1-methyl-3-[(4Z)-4-[(2…
| 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) | 1.71 | 6.55 | -56.79 | 1 | 9 | -1 | 137 | 389.347 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 4.79 | -148.16 | 0 | 9 | -2 | 140 | 388.339 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 4.17 | -149.33 | 0 | 9 | -2 | 140 | 388.339 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
