General Information of the Compound
| Compound ID |
CP0965600
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| Compound Name |
3-(1-oxo-5-(1-(3,3,3-trifluoropropyl)piperidin-4-yl)isoindolin-2-yl)piperidine-2,6-dione
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| Structure |
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| Formula |
C21H24F3N3O3
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| Molecular Weight |
423.435
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| Canonical SMILES |
O=C1CCC(N2Cc3cc(C4CCN(CCC(F)(F)F)CC4)ccc3C2=O)C(=O)N1
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| InChI |
InChI=1S/C21H24F3N3O3/c22-21(23,24)7-10-26-8-5-13(6-9-26)14-1-2-16-15(11-14)12-27(20(16)30)17-3-4-18(28)25-19(17)29/h1-2,11,13,17H,3-10,12H2,(H,25,28,29)
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| InChIKey |
OTCSRCQQDSTOQQ-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