General Information of the Compound
| Compound ID |
CP0443190
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| Compound Name |
3-(benzenesulfonyl)-2-methylsulfinylpyrido[1,2-a]pyrimidin-4-imine
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| Structure |
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| Formula |
C15H13N3O3S2
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| Molecular Weight |
347.421
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| Canonical SMILES |
C[S+]([O-])c1nc2ccccn2c(=N)c1S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C15H13N3O3S2/c1-22(19)15-13(23(20,21)11-7-3-2-4-8-11)14(16)18-10-6-5-9-12(18)17-15/h2-10,16H,1H3
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| InChIKey |
FAKZUQQMPVIABM-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