General Information of the Compound
| Compound ID |
CP0486412
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| Compound Name |
(+/-)-1'-(4-bromobenzyl)-1-(methylthiomethyl)-3-phenyl-3,4'-bipiperidine-2,6-dione
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| Structure |
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| Formula |
C25H29BrN2O2S
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| Molecular Weight |
501.49
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| Canonical SMILES |
CSCN1C(=O)CCC(C2CCN(Cc3ccc(Br)cc3)CC2)(C1=O)c1ccccc1
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| InChI |
InChI=1S/C25H29BrN2O2S/c1-31-18-28-23(29)11-14-25(24(28)30,20-5-3-2-4-6-20)21-12-15-27(16-13-21)17-19-7-9-22(26)10-8-19/h2-10,21H,11-18H2,1H3
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| InChIKey |
CZSCZZVPYIQJLF-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