General Information of the Compound
| Compound ID |
CP0531876
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| Compound Name |
1-benzyl-3-(2-oxocyclohexyl)pyrrolidine-2,5-dione
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| Structure |
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| Formula |
C17H19NO3
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| Molecular Weight |
285.343
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| Canonical SMILES |
O=C1CC(C2CCCCC2=O)C(=O)N1Cc1ccccc1
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| InChI |
InChI=1S/C17H19NO3/c19-15-9-5-4-8-13(15)14-10-16(20)18(17(14)21)11-12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-11H2
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| InChIKey |
VEXOJVXZKCAZML-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