General Information of the Compound
| Compound ID |
CP0064543
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| Compound Name |
N-[(2,3-dimethoxyphenyl)methyl]-2-[2-(3-methoxyphenyl)ethyl]aniline
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| Structure |
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| Formula |
C24H27NO3
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| Molecular Weight |
377.484
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| Canonical SMILES |
COc1cccc(CCc2ccccc2NCc2cccc(OC)c2OC)c1
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| InChI |
InChI=1S/C24H27NO3/c1-26-21-11-6-8-18(16-21)14-15-19-9-4-5-12-22(19)25-17-20-10-7-13-23(27-2)24(20)28-3/h4-13,16,25H,14-15,17H2,1-3H3
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| InChIKey |
DNMIEUYXHWQBLV-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