General Information of the Compound
| Compound ID |
CP0416232
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| Compound Name |
2-[4-(2-aminoethoxy)-3-methoxyphenyl]-N-[(4-tert-butylphenyl)methyl]acetamide
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| Structure |
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| Formula |
C22H30N2O3
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| Molecular Weight |
370.493
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| Canonical SMILES |
COc1cc(CC(=O)NCc2ccc(cc2)C(C)(C)C)ccc1OCCN
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| InChI |
InChI=1S/C22H30N2O3/c1-22(2,3)18-8-5-16(6-9-18)15-24-21(25)14-17-7-10-19(27-12-11-23)20(13-17)26-4/h5-10,13H,11-12,14-15,23H2,1-4H3,(H,24,25)
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| InChIKey |
MIFFBZABZJCUMV-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