| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 14 | No |
Popular Name: 3,4-Dimethyl-1-phenyl-1H-pyrazol-5(4H)-one 3,4-Dimethyl-1-phenyl-1H-pyrazol…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 17900-68-4 , [17900-68-4]
2,4-dihydro-4,5-dimethyl-2-phenyl-3H-pyrazol-3-one
3,4-dimethyl-1-phenyl-4,5-dihydro-1H-pyrazol-5-one
| 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) | 2.25 | 5.74 | -10.87 | 0 | 3 | 0 | 33 | 188.23 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.16 | 3.69 | -7.92 | 1 | 3 | 0 | 38 | 188.23 | 1 | ↓ |
