General Information of the Compound
| Compound ID |
CP0385729
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| Compound Name |
4-(2-bromo-4-propan-2-ylphenyl)-8-(dimethylamino)-1-(2-fluoroethyl)-6-methyl-3H-pyrido[2,3-b]pyrazin-2-one
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| Structure |
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| Formula |
C21H26BrFN4O
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| Molecular Weight |
449.368
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| Canonical SMILES |
CC(C)c1ccc(N2CC(=O)N(CCF)c3c(cc(C)nc23)N(C)C)c(Br)c1
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| InChI |
InChI=1S/C21H26BrFN4O/c1-13(2)15-6-7-17(16(22)11-15)27-12-19(28)26(9-8-23)20-18(25(4)5)10-14(3)24-21(20)27/h6-7,10-11,13H,8-9,12H2,1-5H3
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| InChIKey |
OYZLFIMAAMUTKT-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