General Information of the Compound
| Compound ID |
CP0559390
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| Compound Name |
US9192603, 64
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| Structure |
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| Formula |
C19H18ClN3O3S2
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| Molecular Weight |
435.958
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| Canonical SMILES |
CC(C)c1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)Cc1ccccc1Cl
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| InChI |
InChI=1S/C19H18ClN3O3S2/c1-12(2)16-18(28(25,26)11-13-7-3-4-8-14(13)20)27-19(22-16)23-17(24)15-9-5-6-10-21-15/h3-10,12H,11H2,1-2H3,(H,22,23,24)
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| InChIKey |
YYHTYOFNHFJZSY-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