General Information of the Compound
| Compound ID |
CP0520921
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| Compound Name |
5-Methyl-2-phenyl-2H,5H-[1,2,4]triazolo[4,3-a]quinoxaline-1,4-dione
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| Structure |
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| Formula |
C16H12N4O2
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| Molecular Weight |
292.298
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| Canonical SMILES |
Cn1c2ccccc2n2c(nn(-c3ccccc3)c2=O)c1=O
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| InChI |
InChI=1S/C16H12N4O2/c1-18-12-9-5-6-10-13(12)19-14(15(18)21)17-20(16(19)22)11-7-3-2-4-8-11/h2-10H,1H3
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| InChIKey |
OLLSKNKUQGSHMV-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