General Information of the Compound
| Compound ID |
CP0946933
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| Compound Name |
4-(((4-((Benzyloxy)imino)cyclohexyl)methyl)amino)-5-chloro-2-fluoro-N-(thiazol-2-yl)benzenesulfonamide
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| Structure |
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| Formula |
C23H24ClFN4O3S2
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| Molecular Weight |
523.055
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| Canonical SMILES |
O=S(=O)(Nc1nccs1)c1cc(Cl)c(NCC2CCC(=NOCc3ccccc3)CC2)cc1F
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| InChI |
InChI=1S/C23H24ClFN4O3S2/c24-19-12-22(34(30,31)29-23-26-10-11-33-23)20(25)13-21(19)27-14-16-6-8-18(9-7-16)28-32-15-17-4-2-1-3-5-17/h1-5,10-13,16,27H,6-9,14-15H2,(H,26,29)
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| InChIKey |
KLPYGTAZYKQPSL-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