General Information of the Compound
| Compound ID |
CP0145812
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| Compound Name |
2-((4-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)benzyl)(2-ethylbutyl)amino)acetic acid
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| Structure |
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| Formula |
C27H34N2O4
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| Molecular Weight |
450.579
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| Canonical SMILES |
CCC(CC)CN(CC(O)=O)Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1
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| InChI |
InChI=1S/C27H34N2O4/c1-4-21(5-2)17-29(19-26(30)31)18-22-11-13-24(14-12-22)32-16-15-25-20(3)33-27(28-25)23-9-7-6-8-10-23/h6-14,21H,4-5,15-19H2,1-3H3,(H,30,31)
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| InChIKey |
QAQMSWWMDJCGEW-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