General Information of the Compound
| Compound ID |
CP0448052
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| Compound Name |
3-[[7-amino-5-(5-methylfuran-2-yl)pyrazolo[4,3-d]pyrimidin-2-yl]methyl]phenol
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| Structure |
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| Formula |
C17H15N5O2
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| Molecular Weight |
321.34
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| Canonical SMILES |
Cc1ccc(o1)-c1nc(N)c2nn(Cc3cccc(O)c3)cc2n1
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| InChI |
InChI=1S/C17H15N5O2/c1-10-5-6-14(24-10)17-19-13-9-22(21-15(13)16(18)20-17)8-11-3-2-4-12(23)7-11/h2-7,9,23H,8H2,1H3,(H2,18,19,20)
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| InChIKey |
HJZUMFPLMMDYPJ-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
Protein ID: PT01278, Adenosine receptor A2b
Protein ID: PT01279, Adenosine receptor A3