General Information of the Compound
| Compound ID |
CP0956948
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| Compound Name |
4-(3,4-dichloro-2-ethoxyphenylsulfonamido)benzoic acid
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| Structure |
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| Formula |
C15H13Cl2NO5S
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| Molecular Weight |
390.244
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| Canonical SMILES |
CCOc1c(S(=O)(=O)Nc2ccc(C(=O)O)cc2)ccc(Cl)c1Cl
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| InChI |
InChI=1S/C15H13Cl2NO5S/c1-2-23-14-12(8-7-11(16)13(14)17)24(21,22)18-10-5-3-9(4-6-10)15(19)20/h3-8,18H,2H2,1H3,(H,19,20)
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| InChIKey |
UTDVWGZUXVJBHT-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