General Information of the Compound
| Compound ID |
CP0378929
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| Compound Name |
2-[benzyl-[2-(3,4-dimethoxyphenoxy)ethyl]amino]-N-[(2-chlorophenyl)methyl]acetamide
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| Structure |
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| Formula |
C26H29ClN2O4
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| Molecular Weight |
468.981
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| Canonical SMILES |
COc1ccc(OCCN(CC(=O)NCc2ccccc2Cl)Cc2ccccc2)cc1OC
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| InChI |
InChI=1S/C26H29ClN2O4/c1-31-24-13-12-22(16-25(24)32-2)33-15-14-29(18-20-8-4-3-5-9-20)19-26(30)28-17-21-10-6-7-11-23(21)27/h3-13,16H,14-15,17-19H2,1-2H3,(H,28,30)
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| InChIKey |
YSJWIJFFLBQVJN-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