General Information of the Compound
| Compound ID |
CP0952865
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| Compound Name |
8-Benzenesulfonylamino-quinoline-4-carboxylic acid methyl ester
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| Structure |
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| Formula |
C17H14N2O4S
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| Molecular Weight |
342.376
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| Canonical SMILES |
COC(=O)c1ccnc2c(NS(=O)(=O)c3ccccc3)cccc12
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| InChI |
InChI=1S/C17H14N2O4S/c1-23-17(20)14-10-11-18-16-13(14)8-5-9-15(16)19-24(21,22)12-6-3-2-4-7-12/h2-11,19H,1H3
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| InChIKey |
CDSIDYJZGPPHEA-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