General Information of the Compound
| Compound ID |
CP0968674
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| Compound Name |
3-(5-(1-((7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl)piperidin-4-yl)-1-oxoisoindolin-2-yl)piperidine-2,6-dione
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| Structure |
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| Formula |
C28H29N5O4
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| Molecular Weight |
499.571
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| Canonical SMILES |
Cc1ccc2nc(CN3CCC(c4ccc5c(c4)CN(C4CCC(=O)NC4=O)C5=O)CC3)cc(=O)n2c1
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| InChI |
InChI=1S/C28H29N5O4/c1-17-2-6-24-29-21(13-26(35)33(24)14-17)16-31-10-8-18(9-11-31)19-3-4-22-20(12-19)15-32(28(22)37)23-5-7-25(34)30-27(23)36/h2-4,6,12-14,18,23H,5,7-11,15-16H2,1H3,(H,30,34,36)
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| InChIKey |
FBTOTZGPUPYJJA-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