General Information of the Compound
| Compound ID |
CP0066410
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| Compound Name |
CHEBI:31530
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| Synonyms |
(MCI-186)
1-Fenyl-3-methyl-2-pyrazolin-5-on
1-Fenyl-3-methyl-2-pyrazolin-5-on [Czech]
1-Phenyl-3-methyl-5-oxo-2-pyrazoline
1-Phenyl-3-methyl-5-pyrazolone
1-Phenyl-3-methylpyrazolone
1-Phenyl-3-methylpyrazolone-5
2,4-Dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one
3-METHYL-1-PHENYL-2-PYRAZOLIN-5-ONE
3-Methyl-1-phenyl-2-pyrazoline-5-one
3-Methyl-1-phenyl-5-pyrazolone
3-Methyl-1-phenylpyrazol-5-one
5-Methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
5-methyl-2-phenyl-4H-pyrazol-3-one
AE-641/00371017
C.I. Developer 1
CDS1_000986
CI Developer 1
Developer Z
Edarabone
Edaravone
Edaravone (JAN/INN)
Edaravone [INN]
Edaravone(jan)
IN1263
M0687
MCI 186
MCI-186
Methylphenylpyrazolone
Monopyrazolone
Norantipyrine
Norphenazone
Phenyl methyl pyrazolone
Phenylmethylpyrazolone
Radicut
Radicut (TN)
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| Structure |
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| Formula |
C10H10N2O
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| Molecular Weight |
174.203
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| Canonical SMILES |
CC1=NN(C(=O)C1)c1ccccc1
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| InChI |
InChI=1S/C10H10N2O/c1-8-7-10(13)12(11-8)9-5-3-2-4-6-9/h2-6H,7H2,1H3
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| InChIKey |
QELUYTUMUWHWMC-UHFFFAOYSA-N
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| CAS |
89-25-8
115566-83-1
12235-58-4
206195-95-1
52224-17-6
62495-97-0
72134-66-8
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Clinical Information about the Compound