General Information of the Compound
| Compound ID |
CP0464794
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| Compound Name |
2-[5-(3-ethoxyphenyl)-1-(2-methylpropyl)indol-3-yl]acetamide
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| Structure |
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| Formula |
C22H26N2O2
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| Molecular Weight |
350.462
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| Canonical SMILES |
CCOc1cccc(c1)-c1ccc2n(CC(C)C)cc(CC(N)=O)c2c1
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| InChI |
InChI=1S/C22H26N2O2/c1-4-26-19-7-5-6-16(10-19)17-8-9-21-20(11-17)18(12-22(23)25)14-24(21)13-15(2)3/h5-11,14-15H,4,12-13H2,1-3H3,(H2,23,25)
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| InChIKey |
QYLOQQGCXSIVLV-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