General Information of the Compound
| Compound ID |
CP0882061
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| Compound Name |
2-(3-(((4-phenylpiperidin-4-yl)methoxy)methyl)-5-(trifluoromethyl)phenyl)thiazole
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| Structure |
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| Formula |
C23H23F3N2OS
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| Molecular Weight |
432.511
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| Canonical SMILES |
FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2nccs2)c1
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| InChI |
InChI=1S/C23H23F3N2OS/c24-23(25,26)20-13-17(12-18(14-20)21-28-10-11-30-21)15-29-16-22(6-8-27-9-7-22)19-4-2-1-3-5-19/h1-5,10-14,27H,6-9,15-16H2
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| InChIKey |
SXLSEEFJRQZZLR-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