General Information of the Compound
| Compound ID |
CP0668969
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| Compound Name |
Lithium salt of 4-(2,4-dichloro-benzoylamino)-3'-ethoxy-biphenyl-3-carboxylate
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| Structure |
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| Formula |
C22H16Cl2LiNO4
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| Molecular Weight |
436.22
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| Canonical SMILES |
CCOc1cccc(-c2ccc(NC(=O)c3ccc(Cl)cc3Cl)c(C(=O)[O-])c2)c1.[Li+]
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| InChI |
InChI=1S/C22H17Cl2NO4.Li/c1-2-29-16-5-3-4-13(10-16)14-6-9-20(18(11-14)22(27)28)25-21(26)17-8-7-15(23)12-19(17)24;/h3-12H,2H2,1H3,(H,25,26)(H,27,28);/q;+1/p-1
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| InChIKey |
HLAMDBZPMFQILR-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