General Information of the Compound
| Compound ID |
CP0466983
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| Compound Name |
4-(3,5-Bis-trifluoromethyl-benzyloxymethyl)-1-isopropyl-4-phenyl-piperidine
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| Structure |
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| Formula |
C24H27F6NO
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| Molecular Weight |
459.474
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| Canonical SMILES |
CC(C)N1CCC(COCc2cc(cc(c2)C(F)(F)F)C(F)(F)F)(CC1)c1ccccc1
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| InChI |
InChI=1S/C24H27F6NO/c1-17(2)31-10-8-22(9-11-31,19-6-4-3-5-7-19)16-32-15-18-12-20(23(25,26)27)14-21(13-18)24(28,29)30/h3-7,12-14,17H,8-11,15-16H2,1-2H3
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| InChIKey |
OTBVEXMPXATWMB-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