General Information of the Compound
| Compound ID |
CP0970177
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| Compound Name |
methyl 6-((2-chloro-4-(trifluoromethyl)phenoxy)methyl)picolinate
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| Structure |
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| Formula |
C15H11ClF3NO3
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| Molecular Weight |
345.704
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| Canonical SMILES |
COC(=O)c1cccc(COc2ccc(C(F)(F)F)cc2Cl)n1
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| InChI |
InChI=1S/C15H11ClF3NO3/c1-22-14(21)12-4-2-3-10(20-12)8-23-13-6-5-9(7-11(13)16)15(17,18)19/h2-7H,8H2,1H3
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| InChIKey |
GODSKFGHFQEEDW-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