General Information of the Compound
| Compound ID |
CP0543838
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| Compound Name |
4-(3-chlorophenoxy)-N-[5-(trifluoromethyl)-1,3-thiazol-2-yl]butanamide
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| Structure |
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| Formula |
C14H12ClF3N2O2S
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| Molecular Weight |
364.776
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| Canonical SMILES |
FC(F)(F)c1cnc(NC(=O)CCCOc2cccc(Cl)c2)s1
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| InChI |
InChI=1S/C14H12ClF3N2O2S/c15-9-3-1-4-10(7-9)22-6-2-5-12(21)20-13-19-8-11(23-13)14(16,17)18/h1,3-4,7-8H,2,5-6H2,(H,19,20,21)
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| InChIKey |
VATGTBPKFUARQU-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