General Information of the Compound
| Compound ID |
CP0965980
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| Compound Name |
3-(5-(1-([1,1'-biphenyl]-4-ylmethyl)piperidin-4-yl)-1-oxoisoindolin-2-yl)piperidine-2,6-dione
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| Structure |
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| Formula |
C31H31N3O3
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| Molecular Weight |
493.607
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| Canonical SMILES |
O=C1CCC(N2Cc3cc(C4CCN(Cc5ccc(-c6ccccc6)cc5)CC4)ccc3C2=O)C(=O)N1
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| InChI |
InChI=1S/C31H31N3O3/c35-29-13-12-28(30(36)32-29)34-20-26-18-25(10-11-27(26)31(34)37)24-14-16-33(17-15-24)19-21-6-8-23(9-7-21)22-4-2-1-3-5-22/h1-11,18,24,28H,12-17,19-20H2,(H,32,35,36)
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| InChIKey |
DSCUTQDNZRVYJK-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