General Information of the Compound
| Compound ID |
CP0486408
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| Compound Name |
(+/-)-3-(1'-(4-bromobenzyl)-2,6-dioxo-3,4'-bipiperidin-3-yl)-N-methylbenzamide
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| Structure |
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| Formula |
C25H28BrN3O3
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| Molecular Weight |
498.421
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| Canonical SMILES |
CNC(=O)c1cccc(c1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
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| InChI |
InChI=1S/C25H28BrN3O3/c1-27-23(31)18-3-2-4-20(15-18)25(12-9-22(30)28-24(25)32)19-10-13-29(14-11-19)16-17-5-7-21(26)8-6-17/h2-8,15,19H,9-14,16H2,1H3,(H,27,31)(H,28,30,32)
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| InChIKey |
SKDJYBDSINXHGF-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