| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 18th, 2008 | 26 | No |
Popular Name: 3-[(4Z)-4-benzylidene-5-oxo-1H-pyrazol-3-yl]-4-hydroxy-1-methyl-quinolin-2-one 3-[(4Z)-4-benzylidene-5-oxo-1H-p…
| 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) | 1.80 | 6.01 | -51.28 | 1 | 6 | -1 | 91 | 344.35 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 4.61 | -141 | 0 | 6 | -2 | 94 | 343.342 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 3.96 | -140.12 | 0 | 6 | -2 | 94 | 343.342 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 283 | MolMall (formerly Molecular Diversity Preservation International) |
No pre-computed analogs available. Try a structural similarity search.
