General Information of the Compound
| Compound ID |
CP0534965
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| Compound Name |
5-Methyl-1-(3-trifluoromethyl-phenyl)-1H-pyrazole-3-carboxylic acid (2,6-difluoro-phenyl)-amide
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| Structure |
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| Formula |
C18H12F5N3O
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| Molecular Weight |
381.304
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| Canonical SMILES |
Cc1cc(nn1-c1cccc(c1)C(F)(F)F)C(=O)Nc1c(F)cccc1F
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| InChI |
InChI=1S/C18H12F5N3O/c1-10-8-15(17(27)24-16-13(19)6-3-7-14(16)20)25-26(10)12-5-2-4-11(9-12)18(21,22)23/h2-9H,1H3,(H,24,27)
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| InChIKey |
UYNMFHAWNSREHK-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