General Information of the Compound
| Compound ID |
CP0548527
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| Compound Name |
9-[1-(3,5-difluoroanilino)ethyl]-N-(2-hydroxyethyl)-N-methyl-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide
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| Structure |
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| Formula |
C24H27F2N5O4
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| Molecular Weight |
487.507
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| Canonical SMILES |
CC(Nc1cc(F)cc(F)c1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)CCO
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| InChI |
InChI=1S/C24H27F2N5O4/c1-15(27-19-11-17(25)10-18(26)12-19)20-9-16(24(34)29(2)3-6-32)14-31-22(33)13-21(28-23(20)31)30-4-7-35-8-5-30/h9-15,27,32H,3-8H2,1-2H3
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| InChIKey |
IVCJHUDFISLQGI-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