General Information of the Compound
| Compound ID |
CP0132804
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| Compound Name |
9-(1-anilinoethyl)-N-[2-(dimethylamino)ethyl]-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide
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| Structure |
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| Formula |
C25H32N6O3
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| Molecular Weight |
464.57
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| Canonical SMILES |
CC(Nc1ccccc1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)NCCN(C)C
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| InChI |
InChI=1S/C25H32N6O3/c1-18(27-20-7-5-4-6-8-20)21-15-19(25(33)26-9-10-29(2)3)17-31-23(32)16-22(28-24(21)31)30-11-13-34-14-12-30/h4-8,15-18,27H,9-14H2,1-3H3,(H,26,33)
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| InChIKey |
NBNZFOUXNKGZGH-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