General Information of the Compound
| Compound ID |
CP0489443
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| Compound Name |
8-(2-aminophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1(2H)-one
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| Structure |
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| Formula |
C17H14N4O
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| Molecular Weight |
290.326
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| Canonical SMILES |
Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccccc1N
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| InChI |
InChI=1S/C17H14N4O/c1-10-8-16-19-20-17(22)21(16)15-9-11(6-7-12(10)15)13-4-2-3-5-14(13)18/h2-9H,18H2,1H3,(H,20,22)
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| InChIKey |
HTXSNHZPVGVZJV-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