General Information of the Compound
| Compound ID |
CP0482168
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| Compound Name |
methyl 5-(cyclohexanecarbonylamino)-1-[(4-methoxyphenyl)methyl]-2-oxoquinoline-3-carboxylate
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| Structure |
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| Formula |
C26H28N2O5
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| Molecular Weight |
448.519
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| Canonical SMILES |
COC(=O)c1cc2c(NC(=O)C3CCCCC3)cccc2n(Cc2ccc(OC)cc2)c1=O
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| InChI |
InChI=1S/C26H28N2O5/c1-32-19-13-11-17(12-14-19)16-28-23-10-6-9-22(27-24(29)18-7-4-3-5-8-18)20(23)15-21(25(28)30)26(31)33-2/h6,9-15,18H,3-5,7-8,16H2,1-2H3,(H,27,29)
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| InChIKey |
WLBIQCNYNCBMBC-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