In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 18th, 2008 | 29 | No |
Popular Name: (4Z)-2-phenyl-4-[(5-phenyl-2H-pyrazol-3-yl)hydrazono]-5-(trifluoromethyl)pyrazol-3-one (4Z)-2-phenyl-4-[(5-phenyl-2H-py…
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) | 3.81 | 8.95 | -7.31 | 2 | 7 | 0 | 88 | 398.348 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.81 | 8.95 | -11.52 | 2 | 7 | 0 | 88 | 398.348 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.81 | 8.94 | -8.9 | 2 | 7 | 0 | 88 | 398.348 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 280 | MolMall (formerly Molecular Diversity Preservation International) |
No pre-computed analogs available. Try a structural similarity search.