General Information of the Compound
| Compound ID |
CP0454591
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| Compound Name |
8-Methoxy-3-methyl-1-propyl-4-trifluoromethylsulfonylamino-imidazo[1,5-a]pyrido[3,2-e]pyrazine
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| Structure |
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| Formula |
C15H16F3N5O3S
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| Molecular Weight |
403.386
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| Canonical SMILES |
CCCc1nc(C)c2c(NS(=O)(=O)C(F)(F)F)nc3ccc(OC)nc3n12
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| InChI |
InChI=1S/C15H16F3N5O3S/c1-4-5-10-19-8(2)12-13(22-27(24,25)15(16,17)18)20-9-6-7-11(26-3)21-14(9)23(10)12/h6-7H,4-5H2,1-3H3,(H,20,22)
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| InChIKey |
XQJWKDXYEXGJLE-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