General Information of the Compound
| Compound ID |
CP0580144
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| Compound Name |
1-methyl-4-(4-methylphenyl)-2-oxo-8-propyl-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carbonitrile
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| Structure |
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| Formula |
C20H23N3O
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| Molecular Weight |
321.424
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| Canonical SMILES |
CCCC1CNCc2c1n(C)c(=O)c(C#N)c2-c1ccc(C)cc1
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| InChI |
InChI=1S/C20H23N3O/c1-4-5-15-11-22-12-17-18(14-8-6-13(2)7-9-14)16(10-21)20(24)23(3)19(15)17/h6-9,15,22H,4-5,11-12H2,1-3H3
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| InChIKey |
NXKFQMFYVNCKGJ-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