General Information of the Compound
| Compound ID |
CP0868827
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| Compound Name |
3-Chloro-N-(4-methyl-3-((1-nicotinoylpiperidin-4-yl)oxy)phenyl)-5-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C26H23ClF3N3O3
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| Molecular Weight |
517.935
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| Canonical SMILES |
Cc1ccc(NC(=O)c2cc(Cl)cc(C(F)(F)F)c2)cc1OC1CCN(C(=O)c2cccnc2)CC1
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| InChI |
InChI=1S/C26H23ClF3N3O3/c1-16-4-5-21(32-24(34)18-11-19(26(28,29)30)13-20(27)12-18)14-23(16)36-22-6-9-33(10-7-22)25(35)17-3-2-8-31-15-17/h2-5,8,11-15,22H,6-7,9-10H2,1H3,(H,32,34)
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| InChIKey |
MWTBNHSPTKRPIN-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