General Information of the Compound
| Compound ID |
CP0574632
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| Compound Name |
2-fluoro-1-[3-(2-hydroxyphenyl)-5-methyl-3,4-dihydropyrazol-2-yl]ethanone
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| Structure |
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| Formula |
C12H13FN2O2
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| Molecular Weight |
236.246
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| Canonical SMILES |
CC1=NN(C(C1)c1ccccc1O)C(=O)CF
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| InChI |
InChI=1S/C12H13FN2O2/c1-8-6-10(15(14-8)12(17)7-13)9-4-2-3-5-11(9)16/h2-5,10,16H,6-7H2,1H3
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| InChIKey |
OFJYTRDQYZMGFR-UHFFFAOYSA-N
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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