General Information of the Compound
| Compound ID |
CP0451666
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| Compound Name |
N-[5-cyano-4-(2-methoxyethylamino)pyridin-2-yl]-7-formyl-6-[[methyl(2-methylpropanoyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
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| Structure |
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| Formula |
C25H31N7O4
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| Molecular Weight |
493.568
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| Canonical SMILES |
COCCNc1cc(NC(=O)N2CCCc3cc(CN(C)C(=O)C(C)C)c(C=O)nc23)ncc1C#N
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| InChI |
InChI=1S/C25H31N7O4/c1-16(2)24(34)31(3)14-18-10-17-6-5-8-32(23(17)29-21(18)15-33)25(35)30-22-11-20(27-7-9-36-4)19(12-26)13-28-22/h10-11,13,15-16H,5-9,14H2,1-4H3,(H2,27,28,30,35)
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| InChIKey |
UKJUYQHJGNWARG-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