General Information of the Compound
| Compound ID |
CP0944003
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| Compound Name |
N'-(2-Furan-2-yl-8-methyl-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)hydrazinium chloride
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| Structure |
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| Formula |
C11H11ClN8O
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| Molecular Weight |
306.717
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| Canonical SMILES |
Cl.Cn1cc2c(nc(NN)n3nc(-c4ccco4)nc23)n1
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| InChI |
InChI=1S/C11H10N8O.ClH/c1-18-5-6-8(16-18)14-11(15-12)19-10(6)13-9(17-19)7-3-2-4-20-7;/h2-5H,12H2,1H3,(H,14,15,16);1H
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| InChIKey |
NDIRIJNHWDLBRK-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