General Information of the Compound
| Compound ID |
CP0120373
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| Compound Name |
3-oxo-2-(3-piperidin-1-ylpropyl)-1H-isoindole-4-carboxamide
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| Structure |
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| Formula |
C17H23N3O2
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| Molecular Weight |
301.39
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| Canonical SMILES |
NC(=O)c1cccc2CN(CCCN3CCCCC3)C(=O)c12
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| InChI |
InChI=1S/C17H23N3O2/c18-16(21)14-7-4-6-13-12-20(17(22)15(13)14)11-5-10-19-8-2-1-3-9-19/h4,6-7H,1-3,5,8-12H2,(H2,18,21)
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| InChIKey |
GKALQNMQWUAENE-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