General Information of the Compound
| Compound ID |
CP0389642
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| Compound Name |
(+/-)-1'-(4-chloro-3-(trifluoromethyl)benzyl)-3-phenyl-3,4'-bipiperidine-2,6-dione
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| Structure |
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| Formula |
C24H24ClF3N2O2
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| Molecular Weight |
464.915
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| Canonical SMILES |
FC(F)(F)c1cc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2ccccc2)ccc1Cl
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| InChI |
InChI=1S/C24H24ClF3N2O2/c25-20-7-6-16(14-19(20)24(26,27)28)15-30-12-9-18(10-13-30)23(17-4-2-1-3-5-17)11-8-21(31)29-22(23)32/h1-7,14,18H,8-13,15H2,(H,29,31,32)
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| InChIKey |
PKJUWTJQBGFMOT-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