General Information of the Compound
| Compound ID |
CP0547328
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| Compound Name |
5-[(4-methylbenzoyl)amino]-1-[(3,4,5-trifluorophenyl)methyl]pyrazole-3-carboxylic acid
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| Structure |
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| Formula |
C19H14F3N3O3
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| Molecular Weight |
389.333
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| Canonical SMILES |
Cc1ccc(cc1)C(=O)Nc1cc(nn1Cc1cc(F)c(F)c(F)c1)C(O)=O
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| InChI |
InChI=1S/C19H14F3N3O3/c1-10-2-4-12(5-3-10)18(26)23-16-8-15(19(27)28)24-25(16)9-11-6-13(20)17(22)14(21)7-11/h2-8H,9H2,1H3,(H,23,26)(H,27,28)
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| InChIKey |
ZYYFTSVEOBYSQW-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