General Information of the Compound
| Compound ID |
CP0465786
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| Compound Name |
3-[5-(3,5-dimethylphenyl)-4-phenyl-1,3-oxazol-2-yl]propanoic acid
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| Formula |
C20H19NO3
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| Molecular Weight |
321.376
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| Canonical SMILES |
Cc1cc(C)cc(c1)-c1oc(CCC(O)=O)nc1-c1ccccc1
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| InChI |
InChI=1S/C20H19NO3/c1-13-10-14(2)12-16(11-13)20-19(15-6-4-3-5-7-15)21-17(24-20)8-9-18(22)23/h3-7,10-12H,8-9H2,1-2H3,(H,22,23)
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| InChIKey |
RPVYYZNUXXZUPG-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
Protein ID: PT01930, Retinoic acid receptor RXR-alpha
Protein ID: PT01474, Retinoic acid receptor RXR-beta
Protein ID: PT02769, Retinoic acid receptor RXR-gamma