General Information of the Compound
| Compound ID |
CP0443034
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| Compound Name |
3-[4-(cyclohexylmethoxy)phenyl]-3-ethoxypropanoic acid
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| Structure |
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| Formula |
C18H26O4
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| Molecular Weight |
306.402
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| Canonical SMILES |
CCOC(CC(O)=O)c1ccc(OCC2CCCCC2)cc1
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| InChI |
InChI=1S/C18H26O4/c1-2-21-17(12-18(19)20)15-8-10-16(11-9-15)22-13-14-6-4-3-5-7-14/h8-11,14,17H,2-7,12-13H2,1H3,(H,19,20)
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| InChIKey |
HLZBFPAQQMOWQD-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