General Information of the Compound
| Compound ID |
CP0532721
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| Compound Name |
4-(3-Benzyloxy-phenoxy)-4-phenyl-butyric acid
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| Structure |
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| Formula |
C23H22O4
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| Molecular Weight |
362.425
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| Canonical SMILES |
OC(=O)CCC(Oc1cccc(OCc2ccccc2)c1)c1ccccc1
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| InChI |
InChI=1S/C23H22O4/c24-23(25)15-14-22(19-10-5-2-6-11-19)27-21-13-7-12-20(16-21)26-17-18-8-3-1-4-9-18/h1-13,16,22H,14-15,17H2,(H,24,25)
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| InChIKey |
JCFWIDJCYZOMTD-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