General Information of the Compound
| Compound ID |
CP0849176
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| Compound Name |
3-(3-o-tolyl-1,2,4-oxadiazol-5-yl)benzoic acid
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| Structure |
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| Formula |
C16H12N2O3
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| Molecular Weight |
280.283
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| Canonical SMILES |
Cc1ccccc1-c1noc(-c2cccc(C(=O)O)c2)n1
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| InChI |
InChI=1S/C16H12N2O3/c1-10-5-2-3-8-13(10)14-17-15(21-18-14)11-6-4-7-12(9-11)16(19)20/h2-9H,1H3,(H,19,20)
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| InChIKey |
WHNBOVWEWUVNOZ-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