General Information of the Compound
| Compound ID |
CP0692930
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| Compound Name |
Lithium salt of 3'-carboxy-4-(2,4-dichloro-benzoylamino)-biphenyl-3-carboxylate
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| Structure |
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| Formula |
C21H12Cl2LiNO5
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| Molecular Weight |
436.176
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| Canonical SMILES |
O=C(O)c1cccc(-c2ccc(NC(=O)c3ccc(Cl)cc3Cl)c(C(=O)[O-])c2)c1.[Li+]
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| InChI |
InChI=1S/C21H13Cl2NO5.Li/c22-14-5-6-15(17(23)10-14)19(25)24-18-7-4-12(9-16(18)21(28)29)11-2-1-3-13(8-11)20(26)27;/h1-10H,(H,24,25)(H,26,27)(H,28,29);/q;+1/p-1
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| InChIKey |
MERDCNZIYBAXHF-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