General Information of the Compound
| Compound ID |
CP0966502
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| Compound Name |
3-(1-oxo-5-(1,2,5,6-tetrahydropyridin-3-yl)isoindolin-2-yl)piperidine-2,6-dione
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| Structure |
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| Formula |
C18H19N3O3
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| Molecular Weight |
325.368
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| Canonical SMILES |
O=C1CCC(N2Cc3cc(C4=CCCNC4)ccc3C2=O)C(=O)N1
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| InChI |
InChI=1S/C18H19N3O3/c22-16-6-5-15(17(23)20-16)21-10-13-8-11(3-4-14(13)18(21)24)12-2-1-7-19-9-12/h2-4,8,15,19H,1,5-7,9-10H2,(H,20,22,23)
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| InChIKey |
PZNBJEGPNSAPAI-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