General Information of the Compound
| Compound ID |
CP0459105
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| Compound Name |
(+/-)-N-(1-(3,4-dimethylbenzoyl)-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylacetamide
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| Structure |
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| Formula |
C27H28N2O2
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| Molecular Weight |
412.533
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| Canonical SMILES |
CC1CC(N(C(C)=O)c2ccccc2)c2ccccc2N1C(=O)c1ccc(C)c(C)c1
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| InChI |
InChI=1S/C27H28N2O2/c1-18-14-15-22(16-19(18)2)27(31)28-20(3)17-26(24-12-8-9-13-25(24)28)29(21(4)30)23-10-6-5-7-11-23/h5-16,20,26H,17H2,1-4H3
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| InChIKey |
LWTUYNJQSLFRCB-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