General Information of the Compound
| Compound ID |
CP0477754
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| Compound Name |
ethyl 1-[(4-methylphenyl)methyl]indole-2-carboxylate
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| Structure |
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| Formula |
C19H19NO2
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| Molecular Weight |
293.366
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| Canonical SMILES |
CCOC(=O)c1cc2ccccc2n1Cc1ccc(C)cc1
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| InChI |
InChI=1S/C19H19NO2/c1-3-22-19(21)18-12-16-6-4-5-7-17(16)20(18)13-15-10-8-14(2)9-11-15/h4-12H,3,13H2,1-2H3
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| InChIKey |
HCTFJVURTSOPIG-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
Protein ID: PT03645, Nucleotide-binding oligomerization domain-containing protein 1
Protein ID: PT03970, Nucleotide-binding oligomerization domain-containing protein 2