General Information of the Compound
Compound ID |
CP0394136
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Compound Name |
4-benzyl-N-[4-[2-[di(propan-2-yl)amino]ethoxy]-3-methoxyphenyl]-N-methylbenzamide
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Structure |
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Formula |
C30H38N2O3
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Molecular Weight |
474.645
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Canonical SMILES |
COc1cc(ccc1OCCN(C(C)C)C(C)C)N(C)C(=O)c1ccc(Cc2ccccc2)cc1
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InChI |
InChI=1S/C30H38N2O3/c1-22(2)32(23(3)4)18-19-35-28-17-16-27(21-29(28)34-6)31(5)30(33)26-14-12-25(13-15-26)20-24-10-8-7-9-11-24/h7-17,21-23H,18-20H2,1-6H3
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InChIKey |
DBNBDGORBGOFLP-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