General Information of the Compound
| Compound ID |
CP0484204
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| Compound Name |
9-(3-fluorophenyl)-N-(1H-imidazol-2-ylmethyl)-2-morpholin-4-ylpurin-6-amine
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| Structure |
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| Formula |
C19H19FN8O
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| Molecular Weight |
394.414
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| Canonical SMILES |
Fc1cccc(c1)-n1cnc2c(NCc3ncc[nH]3)nc(nc12)N1CCOCC1
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| InChI |
InChI=1S/C19H19FN8O/c20-13-2-1-3-14(10-13)28-12-24-16-17(23-11-15-21-4-5-22-15)25-19(26-18(16)28)27-6-8-29-9-7-27/h1-5,10,12H,6-9,11H2,(H,21,22)(H,23,25,26)
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| InChIKey |
BAKZCLXZBMYRGA-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: PT01351, Casein kinase I isoform delta
Protein ID: PT01551, Casein kinase I isoform epsilon