General Information of the Compound
| Compound ID |
CP0966919
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| Compound Name |
6-((2-chloro-4-(trifluoromethyl)phenoxy)methyl)-3-fluoropicolinic acid
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| Structure |
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| Formula |
C14H8ClF4NO3
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| Molecular Weight |
349.667
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| Canonical SMILES |
O=C(O)c1nc(COc2ccc(C(F)(F)F)cc2Cl)ccc1F
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| InChI |
InChI=1S/C14H8ClF4NO3/c15-9-5-7(14(17,18)19)1-4-11(9)23-6-8-2-3-10(16)12(20-8)13(21)22/h1-5H,6H2,(H,21,22)
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| InChIKey |
KINHXPWGYKBIQA-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