General Information of the Compound
| Compound ID |
CP0959295
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| Compound Name |
6-((2-chloro-4-(trifluoromethyl)phenylamino)methyl)-4-methylpicolinic acid
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| Structure |
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| Formula |
C15H12ClF3N2O2
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| Molecular Weight |
344.72
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| Canonical SMILES |
Cc1cc(CNc2ccc(C(F)(F)F)cc2Cl)nc(C(=O)O)c1
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| InChI |
InChI=1S/C15H12ClF3N2O2/c1-8-4-10(21-13(5-8)14(22)23)7-20-12-3-2-9(6-11(12)16)15(17,18)19/h2-6,20H,7H2,1H3,(H,22,23)
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| InChIKey |
VTWKKVMXCINXIZ-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