General Information of the Compound
| Compound ID |
CP0962224
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| Compound Name |
3-((biphenyl-4-yloxy)methyl)benzoic acid
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| Structure |
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| Formula |
C20H16O3
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| Molecular Weight |
304.345
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| Canonical SMILES |
O=C(O)c1cccc(COc2ccc(-c3ccccc3)cc2)c1
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| InChI |
InChI=1S/C20H16O3/c21-20(22)18-8-4-5-15(13-18)14-23-19-11-9-17(10-12-19)16-6-2-1-3-7-16/h1-13H,14H2,(H,21,22)
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| InChIKey |
UAFSXXNQRUGQOR-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