General Information of the Compound
| Compound ID |
CP0565800
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| Compound Name |
ethyl 3-[4-(dimethylamino)phenyl]benzoate
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| Structure |
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| Formula |
C17H19NO2
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| Molecular Weight |
269.344
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| Canonical SMILES |
CCOC(=O)c1cccc(c1)-c1ccc(cc1)N(C)C
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| InChI |
InChI=1S/C17H19NO2/c1-4-20-17(19)15-7-5-6-14(12-15)13-8-10-16(11-9-13)18(2)3/h5-12H,4H2,1-3H3
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| InChIKey |
ZBLMYNLYQZDCLU-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