| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 14 | No |
Popular Name: 2-(3-aminophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one 2-(3-aminophenyl)-5-methyl-2,4-d…
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CAS Numbers: 292151-88-3 , 90-32-4
1-(3-Aminophenyl)-3-methyl-1H-pyrazol-5(4H)-one
1-(3-aminophenyl)-3-methyl-1H-pyrazol-5-ol
1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one
2-(3-Amino-phenyl)-5-methyl-2,4-dihydro-pyrazol-3-
2-(3-Amino-phenyl)-5-methyl-2,4-dihydro-pyrazol-3-one
2-(3-Amino-phenyl)-5-methyl-2,4-dihydro-pyrazol-3-one hydrochloride
2-(3-aminophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one hydrochloride
2-(3-Aminophenyl)-5-methyl-2,4-dihydro-pyrazol-3-one hydrochloride
2-(3-aminophenyl)-5-methyl-2,4-dihydro-pyrazol-3-onehydrochloride
| 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) | 0.83 | 3.07 | -12.06 | 2 | 4 | 0 | 59 | 189.218 | 1 | ↓ |
| Ref Reference (pH 7) | 0.59 | 2.82 | -15.05 | 3 | 4 | 0 | 64 | 189.218 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.05 | 0.91 | -8.42 | 3 | 4 | 0 | 64 | 189.218 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_PATENT_ID | US4591635 | IBM Patent Data |
