General Information of the Compound
| Compound ID |
CP0406487
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| Compound Name |
4-[4-(2,4-dichlorophenyl)benzoyl]benzoic acid
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| Structure |
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| Formula |
C20H12Cl2O3
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| Molecular Weight |
371.219
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| Canonical SMILES |
OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)-c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C20H12Cl2O3/c21-16-9-10-17(18(22)11-16)12-1-3-13(4-2-12)19(23)14-5-7-15(8-6-14)20(24)25/h1-11H,(H,24,25)
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| InChIKey |
GWUYLVYFOIXRPU-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