General Information of the Compound
| Compound ID |
CP0289244
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| Compound Name |
1-(4-((diethylamino)methyl)benzoyl)-2,3,9,9a-tetrahydro-1H-benzo[de][1,7]naphthyridin-7(8H)-one
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| Structure |
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| Formula |
C23H27N3O2
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| Molecular Weight |
377.488
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| Canonical SMILES |
CCN(CC)Cc1ccc(cc1)C(=O)N1CCc2cccc3C(=O)NCC1c23
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| InChI |
InChI=1S/C23H27N3O2/c1-3-25(4-2)15-16-8-10-18(11-9-16)23(28)26-13-12-17-6-5-7-19-21(17)20(26)14-24-22(19)27/h5-11,20H,3-4,12-15H2,1-2H3,(H,24,27)
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| InChIKey |
QDZQRHYQJZFYFB-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