General Information of the Compound
| Compound ID |
CP0965587
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| Compound Name |
3-(5-(1-(4-(4-methoxypiperidin-1-yl)benzyl)piperidin-4-yl)-1-oxoisoindolin-2-yl)piperidine-2,6-dione
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| Structure |
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| Formula |
C31H38N4O4
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| Molecular Weight |
530.669
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| Canonical SMILES |
COC1CCN(c2ccc(CN3CCC(c4ccc5c(c4)CN(C4CCC(=O)NC4=O)C5=O)CC3)cc2)CC1
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| InChI |
InChI=1S/C31H38N4O4/c1-39-26-12-16-34(17-13-26)25-5-2-21(3-6-25)19-33-14-10-22(11-15-33)23-4-7-27-24(18-23)20-35(31(27)38)28-8-9-29(36)32-30(28)37/h2-7,18,22,26,28H,8-17,19-20H2,1H3,(H,32,36,37)
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| InChIKey |
IMVMTNVPVNYNDP-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