General Information of the Compound
| Compound ID |
CP0683441
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| Compound Name |
Lithium salt of 2-(2,4-dichloro-benzoylamino)-5-(4-ethoxy-benzyloxy)-benzoate
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| Structure |
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| Formula |
C23H18Cl2LiNO5
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| Molecular Weight |
466.246
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| Canonical SMILES |
CCOc1ccc(COc2ccc(NC(=O)c3ccc(Cl)cc3Cl)c(C(=O)[O-])c2)cc1.[Li+]
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| InChI |
InChI=1S/C23H19Cl2NO5.Li/c1-2-30-16-6-3-14(4-7-16)13-31-17-8-10-21(19(12-17)23(28)29)26-22(27)18-9-5-15(24)11-20(18)25;/h3-12H,2,13H2,1H3,(H,26,27)(H,28,29);/q;+1/p-1
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| InChIKey |
SFLYBKKRJNHVFA-UHFFFAOYSA-M
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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