General Information of the Compound
| Compound ID |
CP0496149
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| Compound Name |
(+/-)-N-(1-benzoyl-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-ethylacetamide
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| Structure |
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| Formula |
C21H24N2O2
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| Molecular Weight |
336.435
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| Canonical SMILES |
CCN(C1CC(C)N(C(=O)c2ccccc2)c2ccccc12)C(C)=O
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| InChI |
InChI=1S/C21H24N2O2/c1-4-22(16(3)24)20-14-15(2)23(19-13-9-8-12-18(19)20)21(25)17-10-6-5-7-11-17/h5-13,15,20H,4,14H2,1-3H3
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| InChIKey |
VMJCLQJBRYQRGX-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