General Information of the Compound
| Compound ID |
CP0514463
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| Compound Name |
5-methyl-8-(4-(morpholinomethyl)phenyl)-[1,2,4]triazolo[4,3-a]quinolin-1(2H)-one
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| Structure |
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| Formula |
C22H22N4O2
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| Molecular Weight |
374.444
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| Canonical SMILES |
Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(CN2CCOCC2)cc1
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| InChI |
InChI=1S/C22H22N4O2/c1-15-12-21-23-24-22(27)26(21)20-13-18(6-7-19(15)20)17-4-2-16(3-5-17)14-25-8-10-28-11-9-25/h2-7,12-13H,8-11,14H2,1H3,(H,24,27)
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| InChIKey |
RBNFNKAFYAOLKT-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