General Information of the Compound
| Compound ID |
CP0446828
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| Compound Name |
5-[1-(4-chlorophenyl)sulfonylazetidin-3-yl]-3-(3-methylphenyl)-1,2,4-oxadiazole
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| Structure |
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| Formula |
C18H16ClN3O3S
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| Molecular Weight |
389.864
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| Canonical SMILES |
Cc1cccc(c1)-c1noc(n1)C1CN(C1)S(=O)(=O)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C18H16ClN3O3S/c1-12-3-2-4-13(9-12)17-20-18(25-21-17)14-10-22(11-14)26(23,24)16-7-5-15(19)6-8-16/h2-9,14H,10-11H2,1H3
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| InChIKey |
YHEICCZGDJGUTG-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