General Information of the Compound
| Compound ID |
CP0532166
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| Compound Name |
N-[1-(3-hydroxypropyl)piperidin-4-yl]-4-[[4-(trifluoromethyl)phenoxy]methyl]benzamide
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| Structure |
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| Formula |
C23H27F3N2O3
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| Molecular Weight |
436.474
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| Canonical SMILES |
OCCCN1CCC(CC1)NC(=O)c1ccc(COc2ccc(cc2)C(F)(F)F)cc1
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| InChI |
InChI=1S/C23H27F3N2O3/c24-23(25,26)19-6-8-21(9-7-19)31-16-17-2-4-18(5-3-17)22(30)27-20-10-13-28(14-11-20)12-1-15-29/h2-9,20,29H,1,10-16H2,(H,27,30)
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| InChIKey |
DPHUOMOEIRXIQO-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