General Information of the Compound
| Compound ID |
CP0391541
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| Compound Name |
3-(4-Chloro-2-methyl-phenyl)-5-(3-chloro-thiophen-2-yl)-[1,2,4]oxadiazole
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| Structure |
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| Formula |
C13H8Cl2N2OS
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| Molecular Weight |
311.193
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| Canonical SMILES |
Cc1cc(Cl)ccc1-c1noc(n1)-c1sccc1Cl
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| InChI |
InChI=1S/C13H8Cl2N2OS/c1-7-6-8(14)2-3-9(7)12-16-13(18-17-12)11-10(15)4-5-19-11/h2-6H,1H3
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| InChIKey |
ULHQRBIAFHAWLV-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