General Information of the Compound
| Compound ID |
CP0475503
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| Compound Name |
4-(2-bromo-4-methylphenyl)-8-[butyl(ethyl)amino]-6-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one
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| Structure |
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| Formula |
C21H27BrN4O
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| Molecular Weight |
431.378
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| Canonical SMILES |
CCCCN(CC)c1cc(C)nc2N(CC(=O)Nc12)c1ccc(C)cc1Br
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| InChI |
InChI=1S/C21H27BrN4O/c1-5-7-10-25(6-2)18-12-15(4)23-21-20(18)24-19(27)13-26(21)17-9-8-14(3)11-16(17)22/h8-9,11-12H,5-7,10,13H2,1-4H3,(H,24,27)
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| InChIKey |
UISHDOZKMNUZRV-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