General Information of the Compound
| Compound ID |
CP0109918
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| Compound Name |
N-[[4-(dimethylsulfamoyl)phenyl]carbamothioyl]-4-phenylbenzamide
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| Structure |
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| Formula |
C22H21N3O3S2
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| Molecular Weight |
439.562
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| Canonical SMILES |
CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)c2ccc(cc2)-c2ccccc2)cc1
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| InChI |
InChI=1S/C22H21N3O3S2/c1-25(2)30(27,28)20-14-12-19(13-15-20)23-22(29)24-21(26)18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-15H,1-2H3,(H2,23,24,26,29)
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| InChIKey |
LQNPWLVTDAGCTJ-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