| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2008 | 21 | Yes |
Popular Name: 4-Benzoyl-2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one 4-Benzoyl-2,4-dihydro-5-methyl-2…
Find On: PubMed — Wikipedia — Google
CAS Number: 4551-69-3
(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)(phenyl)methanone
4-Benzoyl-3-methyl-1-phenyl-5-pyrazolinone
| 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) | 3.17 | 7.35 | -53.75 | 0 | 4 | -1 | 58 | 277.303 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.17 | 6.58 | -11.74 | 1 | 4 | 0 | 55 | 278.311 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 90-92? | Alfa-Aesar |
| Melting_Point | 90-92° | Alfa-Aesar |
