General Information of the Compound
| Compound ID |
CP0446827
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| Compound Name |
3-(3-methylphenyl)-5-[1-(4-methylphenyl)sulfonylazetidin-3-yl]-1,2,4-oxadiazole
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| Structure |
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| Formula |
C19H19N3O3S
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| Molecular Weight |
369.446
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| Canonical SMILES |
Cc1ccc(cc1)S(=O)(=O)N1CC(C1)c1nc(no1)-c1cccc(C)c1
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| InChI |
InChI=1S/C19H19N3O3S/c1-13-6-8-17(9-7-13)26(23,24)22-11-16(12-22)19-20-18(21-25-19)15-5-3-4-14(2)10-15/h3-10,16H,11-12H2,1-2H3
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| InChIKey |
SWXBGQYIGJODGL-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