General Information of the Compound
| Compound ID |
CP0199405
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| Compound Name |
2-(4-bromo-2,5-dimethoxyphenyl)-N-[(2,6-dimethoxyphenyl)methyl]ethanamine
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| Structure |
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| Formula |
C19H24BrNO4
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| Molecular Weight |
410.308
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| Canonical SMILES |
COc1cccc(OC)c1CNCCc1cc(OC)c(Br)cc1OC
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| InChI |
InChI=1S/C19H24BrNO4/c1-22-16-6-5-7-17(23-2)14(16)12-21-9-8-13-10-19(25-4)15(20)11-18(13)24-3/h5-7,10-11,21H,8-9,12H2,1-4H3
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| InChIKey |
LTMHOYKRAWHOMY-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