General Information of the Compound
| Compound ID |
CP0258574
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| Compound Name |
8-[(3,5-difluoroanilino)methyl]-N,N-dimethyl-2-morpholin-4-yl-4-oxochromene-6-carboxamide
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| Structure |
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| Formula |
C23H23F2N3O4
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| Molecular Weight |
443.45
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| Canonical SMILES |
CN(C)C(=O)c1cc(CNc2cc(F)cc(F)c2)c2oc(cc(=O)c2c1)N1CCOCC1
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| InChI |
InChI=1S/C23H23F2N3O4/c1-27(2)23(30)14-7-15(13-26-18-10-16(24)9-17(25)11-18)22-19(8-14)20(29)12-21(32-22)28-3-5-31-6-4-28/h7-12,26H,3-6,13H2,1-2H3
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| InChIKey |
SKJQTAKRMQWQSC-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