| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 18th, 2008 | 18 | No |
Popular Name: (4Z)-4-(phenylhydrazono)-5-(trifluoromethyl)-2H-pyrazol-3-one (4Z)-4-(phenylhydrazono)-5-(trif…
None
| 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) | 2.75 | 1.2 | -40.64 | 1 | 5 | -1 | 73 | 255.179 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.48 | 0.66 | -121.43 | 0 | 5 | -2 | 75 | 254.171 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.29 | 2.83 | -4.98 | 2 | 5 | 0 | 70 | 256.187 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.48 | -0.02 | -7.93 | 2 | 5 | 0 | 74 | 256.187 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.02 | 2.69 | -15.14 | 2 | 5 | 0 | 73 | 256.187 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 185 | MolMall (formerly Molecular Diversity Preservation International) |
No pre-computed analogs available. Try a structural similarity search.
