General Information of the Compound
| Compound ID |
CP0549594
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| Compound Name |
6-[[acetyl(methyl)amino]methyl]-N-[5-cyano-4-(propan-2-ylamino)pyridin-2-yl]-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
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| Structure |
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| Formula |
C23H27N7O3
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| Molecular Weight |
449.515
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| Canonical SMILES |
CC(C)Nc1cc(NC(=O)N2CCCc3cc(CN(C)C(C)=O)c(C=O)nc23)ncc1C#N
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| InChI |
InChI=1S/C23H27N7O3/c1-14(2)26-19-9-21(25-11-18(19)10-24)28-23(33)30-7-5-6-16-8-17(12-29(4)15(3)32)20(13-31)27-22(16)30/h8-9,11,13-14H,5-7,12H2,1-4H3,(H2,25,26,28,33)
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| InChIKey |
JSQVANACZJNWAP-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