General Information of the Compound
| Compound ID |
CP0965594
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| Compound Name |
3-(5-(1-(2,2-difluoro-1-phenylethyl)piperidin-4-yl)-1-oxoisoindolin-2-yl)piperidine-2,6-dione
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| Structure |
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| Formula |
C26H27F2N3O3
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| Molecular Weight |
467.516
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| Canonical SMILES |
O=C1CCC(N2Cc3cc(C4CCN(C(c5ccccc5)C(F)F)CC4)ccc3C2=O)C(=O)N1
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| InChI |
InChI=1S/C26H27F2N3O3/c27-24(28)23(17-4-2-1-3-5-17)30-12-10-16(11-13-30)18-6-7-20-19(14-18)15-31(26(20)34)21-8-9-22(32)29-25(21)33/h1-7,14,16,21,23-24H,8-13,15H2,(H,29,32,33)
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| InChIKey |
FDTKKYMXWLXWHH-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