General Information of the Compound
| Compound ID |
CP0150367
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| Compound Name |
2-(1-(6-(2-ethylphenoxy)pyrimidin-4-yl)piperidin-4-yloxy)-5-fluoropyrimidin-4-amine
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| Structure |
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| Formula |
C21H23FN6O2
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| Molecular Weight |
410.453
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| Canonical SMILES |
CCc1ccccc1Oc1cc(ncn1)N1CCC(CC1)Oc1ncc(F)c(N)n1
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| InChI |
InChI=1S/C21H23FN6O2/c1-2-14-5-3-4-6-17(14)30-19-11-18(25-13-26-19)28-9-7-15(8-10-28)29-21-24-12-16(22)20(23)27-21/h3-6,11-13,15H,2,7-10H2,1H3,(H2,23,24,27)
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| InChIKey |
QFUNVSAPMCROCD-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