General Information of the Compound
| Compound ID |
CP0386095
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| Compound Name |
3-(4-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)naphthalen-1-yl)-2-propoxypropanoic acid
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| Structure |
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| Formula |
C28H29NO5
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| Molecular Weight |
459.542
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| Canonical SMILES |
CCCOC(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)c2ccccc12)C(O)=O
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| InChI |
InChI=1S/C28H29NO5/c1-3-16-32-26(28(30)31)18-21-13-14-25(23-12-8-7-11-22(21)23)33-17-15-24-19(2)34-27(29-24)20-9-5-4-6-10-20/h4-14,26H,3,15-18H2,1-2H3,(H,30,31)
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| InChIKey |
DVIBSRAWYQNSOH-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