General Information of the Compound
| Compound ID |
CP0950515
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| Compound Name |
3-(5-(1-ethylpiperidin-4-yl)-1-oxoisoindolin-2-yl)piperidine-2,6-dione
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| Structure |
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| Formula |
C20H25N3O3
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| Molecular Weight |
355.438
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| Canonical SMILES |
CCN1CCC(c2ccc3c(c2)CN(C2CCC(=O)NC2=O)C3=O)CC1
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| InChI |
InChI=1S/C20H25N3O3/c1-2-22-9-7-13(8-10-22)14-3-4-16-15(11-14)12-23(20(16)26)17-5-6-18(24)21-19(17)25/h3-4,11,13,17H,2,5-10,12H2,1H3,(H,21,24,25)
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| InChIKey |
HZOMXCTYEUEIIG-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