General Information of the Compound
Compound ID |
CP0204724
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Compound Name |
N-[2-[(4-ethoxy-2,5-dimethylphenyl)methylamino]-1-phenylethyl]-5-methyl-1,2-oxazole-3-carboxamide
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Structure |
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Formula |
C24H29N3O3
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Molecular Weight |
407.514
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Canonical SMILES |
CCOc1cc(C)c(CNCC(NC(=O)c2cc(C)on2)c2ccccc2)cc1C
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InChI |
InChI=1S/C24H29N3O3/c1-5-29-23-12-16(2)20(11-17(23)3)14-25-15-22(19-9-7-6-8-10-19)26-24(28)21-13-18(4)30-27-21/h6-13,22,25H,5,14-15H2,1-4H3,(H,26,28)
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InChIKey |
QNCJRHLHDZRTPZ-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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