General Information of the Compound
| Compound ID |
CP0429446
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| Compound Name |
N-(2-chloro-4-methylsulfonylphenyl)-2-[1-(3,5-dimethylphenyl)sulfonylbenzimidazol-2-yl]oxyacetamide
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| Structure |
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| Formula |
C24H22ClN3O6S2
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| Molecular Weight |
548.042
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| Canonical SMILES |
Cc1cc(C)cc(c1)S(=O)(=O)n1c(OCC(=O)Nc2ccc(cc2Cl)S(C)(=O)=O)nc2ccccc12
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| InChI |
InChI=1S/C24H22ClN3O6S2/c1-15-10-16(2)12-18(11-15)36(32,33)28-22-7-5-4-6-21(22)27-24(28)34-14-23(29)26-20-9-8-17(13-19(20)25)35(3,30)31/h4-13H,14H2,1-3H3,(H,26,29)
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| InChIKey |
ASSDKAOEJMKTBO-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