General Information of the Compound
| Compound ID |
CP0523805
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| Compound Name |
8-(4-hydroxyphenyl)-5-methyl-2H-[1,2,4]triazolo[4,3-a]quinolin-1-one
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| Structure |
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| Formula |
C17H13N3O2
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| Molecular Weight |
291.31
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| Canonical SMILES |
Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(O)cc1
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| InChI |
InChI=1S/C17H13N3O2/c1-10-8-16-18-19-17(22)20(16)15-9-12(4-7-14(10)15)11-2-5-13(21)6-3-11/h2-9,21H,1H3,(H,19,22)
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| InChIKey |
XDVPSPPTGQHBFO-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