General Information of the Compound
Compound ID |
CP0530155
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Compound Name |
N-(4-chlorophenyl)sulfonyl-3-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy-4-(2-methoxyethoxy)phenyl]propanamide
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Structure |
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Formula |
C24H21Cl2F3N2O6S
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Molecular Weight |
593.407
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Canonical SMILES |
COCCOc1ccc(CCC(=O)NS(=O)(=O)c2ccc(Cl)cc2)c(Oc2ncc(cc2Cl)C(F)(F)F)c1
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InChI |
InChI=1S/C24H21Cl2F3N2O6S/c1-35-10-11-36-18-6-2-15(3-9-22(32)31-38(33,34)19-7-4-17(25)5-8-19)21(13-18)37-23-20(26)12-16(14-30-23)24(27,28)29/h2,4-8,12-14H,3,9-11H2,1H3,(H,31,32)
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InChIKey |
NFBIZSDAEFXMOW-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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