General Information of the Compound
| Compound ID |
CP0456947
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| Compound Name |
3-amino-6-[4-methoxy-3-(phenylsulfamoyl)phenyl]-N-methylpyrazine-2-carboxamide
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| Structure |
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| Formula |
C19H19N5O4S
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| Molecular Weight |
413.459
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| Canonical SMILES |
CNC(=O)c1nc(cnc1N)-c1ccc(OC)c(c1)S(=O)(=O)Nc1ccccc1
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| InChI |
InChI=1S/C19H19N5O4S/c1-21-19(25)17-18(20)22-11-14(23-17)12-8-9-15(28-2)16(10-12)29(26,27)24-13-6-4-3-5-7-13/h3-11,24H,1-2H3,(H2,20,22)(H,21,25)
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| InChIKey |
FBXSSTFHXMDNAW-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
Protein ID: PT01045, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
Protein ID: PT01033, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform
Protein ID: PT00999, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
Protein ID: PT01029, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform