General Information of the Compound
| Compound ID |
CP0864798
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| Compound Name |
2-(5-isopropyl-furan-2-yl)-6-morpholin-4-ylmethyl-thieno[2,3-d]pyrimidin-4-ylamine
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| Structure |
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| Formula |
C18H22N4O2S
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| Molecular Weight |
358.467
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| Canonical SMILES |
CC(C)c1ccc(-c2nc(N)c3cc(CN4CCOCC4)sc3n2)o1
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| InChI |
InChI=1S/C18H22N4O2S/c1-11(2)14-3-4-15(24-14)17-20-16(19)13-9-12(25-18(13)21-17)10-22-5-7-23-8-6-22/h3-4,9,11H,5-8,10H2,1-2H3,(H2,19,20,21)
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| InChIKey |
CWUXDGOITNMQIO-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