General Information of the Compound
| Compound ID |
CP0415795
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| Compound Name |
N-(benzenesulfonyl)-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 |
C24H22ClF3N2O6S
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| Molecular Weight |
558.962
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| Canonical SMILES |
COCCOc1ccc(CCC(=O)NS(=O)(=O)c2ccccc2)c(Oc2ncc(cc2Cl)C(F)(F)F)c1
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| InChI |
InChI=1S/C24H22ClF3N2O6S/c1-34-11-12-35-18-9-7-16(8-10-22(31)30-37(32,33)19-5-3-2-4-6-19)21(14-18)36-23-20(25)13-17(15-29-23)24(26,27)28/h2-7,9,13-15H,8,10-12H2,1H3,(H,30,31)
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| InChIKey |
RXLZVJXUTRDUPX-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