General Information of the Compound
| Compound ID |
CP0965598
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| Compound Name |
3-(5-(1-((2-(tert-butyl)thiazol-4-yl)methyl)piperidin-4-yl)-1-oxoisoindolin-2-yl)piperidine-2,6-dione
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| Structure |
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| Formula |
C26H32N4O3S
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| Molecular Weight |
480.634
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| Canonical SMILES |
CC(C)(C)c1nc(CN2CCC(c3ccc4c(c3)CN(C3CCC(=O)NC3=O)C4=O)CC2)cs1
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| InChI |
InChI=1S/C26H32N4O3S/c1-26(2,3)25-27-19(15-34-25)14-29-10-8-16(9-11-29)17-4-5-20-18(12-17)13-30(24(20)33)21-6-7-22(31)28-23(21)32/h4-5,12,15-16,21H,6-11,13-14H2,1-3H3,(H,28,31,32)
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| InChIKey |
IEHXPBDDBXFKDH-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
Protein ID: PT07271, DNA-binding protein Ikaros
Protein ID: PT07180, Eukaryotic peptide chain release factor GTP-binding subunit ERF3A