| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 9th, 2008 | 25 | No |
Popular Name: (4Z)-4-[(2-hydroxy-1-naphthyl)methylene]-5-methyl-2-phenyl-pyrazol-3-one (4Z)-4-[(2-hydroxy-1-naphthyl)me…
| 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) | 3.95 | 9.18 | -18.36 | 1 | 4 | 0 | 55 | 328.371 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.95 | 9.33 | -44.9 | 0 | 4 | -1 | 58 | 327.363 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.95 | 11.05 | -58.88 | 0 | 4 | -1 | 58 | 327.363 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
