General Information of the Compound
| Compound ID |
CP0951132
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| Compound Name |
3-(5-(1-(benzo[d]thiazol-5-ylmethyl)piperidin-4-yl)-1-oxoisoindolin-2-yl)piperidine-2,6-dione
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| Structure |
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| Formula |
C26H26N4O3S
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| Molecular Weight |
474.586
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| Canonical SMILES |
O=C1CCC(N2Cc3cc(C4CCN(Cc5ccc6scnc6c5)CC4)ccc3C2=O)C(=O)N1
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| InChI |
InChI=1S/C26H26N4O3S/c31-24-6-4-22(25(32)28-24)30-14-19-12-18(2-3-20(19)26(30)33)17-7-9-29(10-8-17)13-16-1-5-23-21(11-16)27-15-34-23/h1-3,5,11-12,15,17,22H,4,6-10,13-14H2,(H,28,31,32)
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| InChIKey |
KVNJEGUBZLNFRH-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