General Information of the Compound
Compound ID |
CP0398309
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Compound Name |
N-[(1S)-1-[3-[4-(4-phenoxyphenoxy)phenyl]-1,2,4-oxadiazol-5-yl]ethyl]acetamide
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Structure |
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Formula |
C24H21N3O4
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Molecular Weight |
415.449
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Canonical SMILES |
C[C@H](NC(C)=O)c1nc(no1)-c1ccc(Oc2ccc(Oc3ccccc3)cc2)cc1
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InChI |
InChI=1S/C24H21N3O4/c1-16(25-17(2)28)24-26-23(27-31-24)18-8-10-20(11-9-18)30-22-14-12-21(13-15-22)29-19-6-4-3-5-7-19/h3-16H,1-2H3,(H,25,28)/t16-/m0/s1
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InChIKey |
KWSDTWPYMWIEPR-INIZCTEOSA-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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