General Information of the Compound
| Compound ID |
CP0512999
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| Compound Name |
5-(4-benzoylphenoxy)pentanoic acid
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| Structure |
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| Formula |
C18H18O4
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| Molecular Weight |
298.338
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| Canonical SMILES |
OC(=O)CCCCOc1ccc(cc1)C(=O)c1ccccc1
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| InChI |
InChI=1S/C18H18O4/c19-17(20)8-4-5-13-22-16-11-9-15(10-12-16)18(21)14-6-2-1-3-7-14/h1-3,6-7,9-12H,4-5,8,13H2,(H,19,20)
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| InChIKey |
VUJRVDDYNPBLRS-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