General Information of the Compound
| Compound ID |
CP0396541
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| Compound Name |
N-[[4-[methyl(phenyl)sulfamoyl]phenyl]carbamothioyl]quinoline-7-carboxamide
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| Structure |
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| Formula |
C24H20N4O3S2
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| Molecular Weight |
476.583
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| Canonical SMILES |
CN(c1ccccc1)S(=O)(=O)c1ccc(NC(=S)NC(=O)c2ccc3cccnc3c2)cc1
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| InChI |
InChI=1S/C24H20N4O3S2/c1-28(20-7-3-2-4-8-20)33(30,31)21-13-11-19(12-14-21)26-24(32)27-23(29)18-10-9-17-6-5-15-25-22(17)16-18/h2-16H,1H3,(H2,26,27,29,32)
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| InChIKey |
IVWAWJHDRYEWDN-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