General Information of the Compound
| Compound ID |
CP0576031
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| Compound Name |
4-(4-chlorophenyl)-2-[[2-(trifluoromethoxy)benzoyl]amino]thiophene-3-carboxylic acid
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| Structure |
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| Formula |
C19H11ClF3NO4S
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| Molecular Weight |
441.814
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| Canonical SMILES |
OC(=O)c1c(NC(=O)c2ccccc2OC(F)(F)F)scc1-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C19H11ClF3NO4S/c20-11-7-5-10(6-8-11)13-9-29-17(15(13)18(26)27)24-16(25)12-3-1-2-4-14(12)28-19(21,22)23/h1-9H,(H,24,25)(H,26,27)
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| InChIKey |
VXCDOVJCDZMFTR-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