General Information of the Compound
| Compound ID |
CP0388768
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| Compound Name |
4-[4-[2-(difluoromethyl)benzimidazol-1-yl]-6-morpholin-4-ylpyrimidin-2-yl]morpholine
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| Structure |
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| Formula |
C20H22F2N6O2
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| Molecular Weight |
416.432
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| Canonical SMILES |
FC(F)c1nc2ccccc2n1-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
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| InChI |
InChI=1S/C20H22F2N6O2/c21-18(22)19-23-14-3-1-2-4-15(14)28(19)17-13-16(26-5-9-29-10-6-26)24-20(25-17)27-7-11-30-12-8-27/h1-4,13,18H,5-12H2
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| InChIKey |
PTQZXNBKPVZFOG-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: PT03525, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
Protein ID: PT01033, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform