General Information of the Compound
| Compound ID |
CP0535455
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| Compound Name |
5-Methyl-1-(3-trifluoromethyl-phenyl)-1H-pyrazole-3-carboxylic acid o-tolylamide
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| Structure |
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| Formula |
C19H16F3N3O
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| Molecular Weight |
359.351
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| Canonical SMILES |
Cc1cc(nn1-c1cccc(c1)C(F)(F)F)C(=O)Nc1ccccc1C
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| InChI |
InChI=1S/C19H16F3N3O/c1-12-6-3-4-9-16(12)23-18(26)17-10-13(2)25(24-17)15-8-5-7-14(11-15)19(20,21)22/h3-11H,1-2H3,(H,23,26)
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| InChIKey |
KGTJFSVEPZJCFT-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