General Information of the Compound
| Compound ID |
CP0496592
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| Compound Name |
N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]-2-morpholin-4-ylacetamide
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| Structure |
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| Formula |
C17H18N6O3
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| Molecular Weight |
354.37
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| Canonical SMILES |
O=C(CN1CCOCC1)Nc1cc(nc(n1)-c1ccco1)-n1cccn1
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| InChI |
InChI=1S/C17H18N6O3/c24-16(12-22-6-9-25-10-7-22)19-14-11-15(23-5-2-4-18-23)21-17(20-14)13-3-1-8-26-13/h1-5,8,11H,6-7,9-10,12H2,(H,19,20,21,24)
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| InChIKey |
LGUMAGBOHGGARE-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: PT00840, Adenosine receptor A1
Protein ID: PT00862, Adenosine receptor A2a