General Information of the Compound
| Compound ID |
CP0871669
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| Compound Name |
3-(4-(1-Phenylethoxy)phenyl)propanoic acid
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| Structure |
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| Formula |
C17H18O3
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| Molecular Weight |
270.328
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| Canonical SMILES |
CC(Oc1ccc(CCC(=O)O)cc1)c1ccccc1
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| InChI |
InChI=1S/C17H18O3/c1-13(15-5-3-2-4-6-15)20-16-10-7-14(8-11-16)9-12-17(18)19/h2-8,10-11,13H,9,12H2,1H3,(H,18,19)
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| InChIKey |
CGKRSIDGRDOCIX-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