General Information of the Compound
Compound ID |
CP0367910
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Compound Name |
2-(5-chloropyridin-3-yl)oxy-5-[[2-chloro-4-(trifluoromethyl)phenyl]sulfonylamino]-N-ethylbenzamide
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Structure |
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Formula |
C21H16Cl2F3N3O4S
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Molecular Weight |
534.343
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Canonical SMILES |
CCNC(=O)c1cc(NS(=O)(=O)c2ccc(cc2Cl)C(F)(F)F)ccc1Oc1cncc(Cl)c1
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InChI |
InChI=1S/C21H16Cl2F3N3O4S/c1-2-28-20(30)16-9-14(4-5-18(16)33-15-8-13(22)10-27-11-15)29-34(31,32)19-6-3-12(7-17(19)23)21(24,25)26/h3-11,29H,2H2,1H3,(H,28,30)
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InChIKey |
HKPZGTVJXKCQLL-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