General Information of the Compound
| Compound ID |
CP0969290
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| Compound Name |
3-(5-(1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)piperidin-4-yl)-1-oxoisoindolin-2-yl)piperidine-2,6-dione
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| Structure |
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| Formula |
C25H26N6O3
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| Molecular Weight |
458.522
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| Canonical SMILES |
O=C1CCC(N2Cc3cc(C4CCN(Cc5cnc6ncccn56)CC4)ccc3C2=O)C(=O)N1
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| InChI |
InChI=1S/C25H26N6O3/c32-22-5-4-21(23(33)28-22)31-14-18-12-17(2-3-20(18)24(31)34)16-6-10-29(11-7-16)15-19-13-27-25-26-8-1-9-30(19)25/h1-3,8-9,12-13,16,21H,4-7,10-11,14-15H2,(H,28,32,33)
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| InChIKey |
ICQRDBKJZOZFQK-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