General Information of the Compound
| Compound ID |
CP0959277
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| Compound Name |
3-(5-(1-((5-methyl-3-phenylisoxazol-4-yl)methyl)piperidin-4-yl)-1-oxoisoindolin-2-yl)piperidine-2,6-dione
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| Structure |
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| Formula |
C29H30N4O4
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| Molecular Weight |
498.583
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| Canonical SMILES |
Cc1onc(-c2ccccc2)c1CN1CCC(c2ccc3c(c2)CN(C2CCC(=O)NC2=O)C3=O)CC1
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| InChI |
InChI=1S/C29H30N4O4/c1-18-24(27(31-37-18)20-5-3-2-4-6-20)17-32-13-11-19(12-14-32)21-7-8-23-22(15-21)16-33(29(23)36)25-9-10-26(34)30-28(25)35/h2-8,15,19,25H,9-14,16-17H2,1H3,(H,30,34,35)
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| InChIKey |
VHBCICTUEUBWFY-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