General Information of the Compound
| Compound ID |
CP0563540
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| Compound Name |
4-[4-[[3-(2,6-dimethylphenyl)-5-propan-2-yl-1,2-oxazol-4-yl]methoxy]phenyl]butanoic acid
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| Structure |
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| Formula |
C25H29NO4
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| Molecular Weight |
407.51
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| Canonical SMILES |
CC(C)c1onc(c1COc1ccc(CCCC(O)=O)cc1)-c1c(C)cccc1C
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| InChI |
InChI=1S/C25H29NO4/c1-16(2)25-21(24(26-30-25)23-17(3)7-5-8-18(23)4)15-29-20-13-11-19(12-14-20)9-6-10-22(27)28/h5,7-8,11-14,16H,6,9-10,15H2,1-4H3,(H,27,28)
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| InChIKey |
AQMUZRASDFXFDB-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