General Information of the Compound
| Compound ID |
CP0191323
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| Compound Name |
4-[5-(methoxymethyl)-2-[(6-methoxypyridin-3-yl)amino]pyridin-3-yl]-6-methyl-1,3,5-triazin-2-amine
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| Structure |
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| Formula |
C17H19N7O2
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| Molecular Weight |
353.386
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| Canonical SMILES |
COCc1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc(N)n1
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| InChI |
InChI=1S/C17H19N7O2/c1-10-21-16(24-17(18)22-10)13-6-11(9-25-2)7-20-15(13)23-12-4-5-14(26-3)19-8-12/h4-8H,9H2,1-3H3,(H,20,23)(H2,18,21,22,24)
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| InChIKey |
DLFVITASTHEQDC-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