General Information of the Compound
| Compound ID |
CP0876752
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| Compound Name |
N-((5-(4-ethoxybenzyl)-1,3,4-oxadiazol-2-yl)methyl)-N-(2,3-dichlorophenyl)-4-(trifluoromethyl)benzenesulfonamide
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| Structure |
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| Formula |
C25H20Cl2F3N3O4S
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| Molecular Weight |
586.419
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| Canonical SMILES |
CCOc1ccc(Cc2nnc(CN(c3cccc(Cl)c3Cl)S(=O)(=O)c3ccc(C(F)(F)F)cc3)o2)cc1
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| InChI |
InChI=1S/C25H20Cl2F3N3O4S/c1-2-36-18-10-6-16(7-11-18)14-22-31-32-23(37-22)15-33(21-5-3-4-20(26)24(21)27)38(34,35)19-12-8-17(9-13-19)25(28,29)30/h3-13H,2,14-15H2,1H3
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| InChIKey |
PFYSVUQJEFVNMV-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