General Information of the Compound
Compound ID
CP0708191
Compound Name
TECADENOSON
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Synonyms
CVT-510
(2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-[[(3R)-oxolan-3-yl]amino]purin-9-yl]oxolane-3,4-diol
204512-90-3
AC1L4KMO
Adenosine, N-(3R)-tetrahydro-3-furanyl)-
Adenosine, N-(3R)-tetrahydro-3-furanyl-
BDBM50138530
BDBM50224766
CHEMBL356254
CHEMBL392149
CS-0016174
CVT-510
D06019
DB04954
DTXSID80174415
GTPL5592
GZ1X96601Z
HY-19661
LS-190860
N-(3-Tetrahydrofuranyl)-6-aminopurine riboside
N6-[3-(R)-tetrahydrofuranyl]adenosine
SCHEMBL246787
Selenocompounds
Tecadenoson
Tecadenoson (USAN/INN)
Tecadenoson [USAN:INN]
UNII-GZ1X96601Z
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Structure
Formula
C14H19N5O5
Molecular Weight
337.336
Canonical SMILES
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCOC4)ncnc32)[C@H](O)[C@@H]1O
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InChI
InChI=1S/C14H19N5O5/c20-3-8-10(21)11(22)14(24-8)19-6-17-9-12(15-5-16-13(9)19)18-7-1-2-23-4-7/h5-8,10-11,14,20-22H,1-4H2,(H,15,16,18)/t7-,8-,10-,11-,14-/m1/s1
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InChIKey
OESBDSFYJMDRJY-BAYCTPFLSA-N
CAS
204512-90-3
Physicochemical Property
logP
-1.3614
Rotatable Bonds
4
Heavy Atom Count
24
Polar Areas
134.78
Hydrogen Bond Donor Count
4
Hydrogen Bond Acceptor Count
10
Complexity
24

"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).

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PubChem ID
CID: 158795
SID: 12015133
ChEMBL ID
CHEMBL392149
DrugBank ID
DB04954
Map of Molecular Bioactivity Related to the Compound
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
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00840, Adenosine receptor A1
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000331 DDT1-MF2
 Cell Line Info 
Mesocricetus auratus (Golden hamster)  2
1
IC50 = 8.2 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
2
Ki = 65 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  1
1
Ki = 2.05 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
CL000665 DDT1
 Cell Line Info 
Mesocricetus auratus (Golden hamster)  1
1
Ki = 3 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Protein ID: PT00862, Adenosine receptor A2a
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  1
1
Ki = 2315 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  1
1
Ki = 6390 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
CL000028 PC-12
 Cell Line Info 
Homo sapiens (Human)  1
1
Ki > 100000 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Protein ID: PT01278, Adenosine receptor A2b
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  1
1
Ki = 227 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Protein ID: PT01279, Adenosine receptor A3
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  1
1
Ki = 25800 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( Tecadenoson )
Drug Name Tecadenoson
Company CV Therapeutics
Indication
Cardiac arrhythmias
Discontinued in Phase 3
Atrial fibrillation
Discontinued in Phase 3
Target(s)
Adenosine A1 receptor (ADORA1)
 Target Info 
Agonist