General Information of the Compound
| Compound ID |
CP0438065
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| Compound Name |
2-methyl-N-(2-methylphenyl)-5-oxo-4-propyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
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| Structure |
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| Formula |
C21H26N2O2
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| Molecular Weight |
338.451
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| Canonical SMILES |
CCCC1C(C(=O)Nc2ccccc2C)=C(C)NC2=C1C(=O)CCC2
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| InChI |
InChI=1S/C21H26N2O2/c1-4-8-15-19(21(25)23-16-10-6-5-9-13(16)2)14(3)22-17-11-7-12-18(24)20(15)17/h5-6,9-10,15,22H,4,7-8,11-12H2,1-3H3,(H,23,25)
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| InChIKey |
ZCSQXXUXMHTANR-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