General Information of the Compound
| Compound ID |
CP0065980
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| Compound Name |
9-Ethyl-9H-adenine
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| Synonyms |
(9-ethylpurin-6-yl)amine
2715-68-6
6-Amino-9-ethylpurine
9-Ethyl-9H-adenine
9-Ethyl-9H-purin-6-ylamine
9-Ethyladenine
9-ethyl adenine
9-ethyl-9h-purin-6-amine
9-ethylpurin-6-amine
9H-Purin-6-amine, 9-ethyl-
9H-Purin-6-amine,9-ethyl
9H-Purin-6-amine,9-ethyl-
AC1L189M
AC1Q4VHH
ACMC-1CJP6
Adenine, 9-ethyl-
Adenine, 9-ethyl- (8CI)
CHEMBL304009
CTK4F9170
DTXSID50181616
KS-000000ID
MUIPLRMGAXZWSQ-UHFFFAOYSA-N
MolPort-004-964-357
N9 -ethyladenine
N9-Ethyladenine
NSC 14580
NSC14580
SCHEMBL1924594
ZINC402896
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| Structure |
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| Formula |
C7H9N5
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| Molecular Weight |
163.184
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| Canonical SMILES |
CCn1cnc2c(N)ncnc12
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| InChI |
InChI=1S/C7H9N5/c1-2-12-4-11-5-6(8)9-3-10-7(5)12/h3-4H,2H2,1H3,(H2,8,9,10)
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| InChIKey |
MUIPLRMGAXZWSQ-UHFFFAOYSA-N
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| CAS |
2715-68-6
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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
Clinical Information about the Compound