General Information of the Compound
| Compound ID |
CP0347599
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| Compound Name |
3-(4-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)-2-((3-phenylpropanamido)methyl)phenyl)propanoic acid
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| Structure |
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| Formula |
C31H32N2O5
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| Molecular Weight |
512.606
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| Canonical SMILES |
Cc1oc(nc1CCOc1ccc(CCC(O)=O)c(CNC(=O)CCc2ccccc2)c1)-c1ccccc1
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| InChI |
InChI=1S/C31H32N2O5/c1-22-28(33-31(38-22)25-10-6-3-7-11-25)18-19-37-27-15-13-24(14-17-30(35)36)26(20-27)21-32-29(34)16-12-23-8-4-2-5-9-23/h2-11,13,15,20H,12,14,16-19,21H2,1H3,(H,32,34)(H,35,36)
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| InChIKey |
GWVGBNLWVXZVGV-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