General Information of the Compound
| Compound ID |
CP0256604
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| Compound Name |
3-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]-1-(2-methylpropoxycarbonyl)piperidine-4-carboxylic acid
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| Structure |
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| Formula |
C30H36N2O6
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| Molecular Weight |
520.626
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| Canonical SMILES |
CC(C)COC(=O)N1CCC(C(Cc2ccc(OCCc3nc(oc3C)-c3ccccc3)cc2)C1)C(O)=O
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| InChI |
InChI=1S/C30H36N2O6/c1-20(2)19-37-30(35)32-15-13-26(29(33)34)24(18-32)17-22-9-11-25(12-10-22)36-16-14-27-21(3)38-28(31-27)23-7-5-4-6-8-23/h4-12,20,24,26H,13-19H2,1-3H3,(H,33,34)
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| InChIKey |
KIAYYQXSCFRAQS-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