General Information of the Compound
| Compound ID |
CP0576594
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| Compound Name |
4-(4-chlorophenyl)-2-[(2,6-dichlorobenzoyl)amino]thiophene-3-carboxylic acid
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| Structure |
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| Formula |
C18H10Cl3NO3S
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| Molecular Weight |
426.708
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| Canonical SMILES |
OC(=O)c1c(NC(=O)c2c(Cl)cccc2Cl)scc1-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C18H10Cl3NO3S/c19-10-6-4-9(5-7-10)11-8-26-17(14(11)18(24)25)22-16(23)15-12(20)2-1-3-13(15)21/h1-8H,(H,22,23)(H,24,25)
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| InChIKey |
AQBUKCGFBCBZBH-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