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BDBM50452202 CHEMBL2113424

SMILES: OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCCCCC3)ncnc12

InChI Key: InChIKey=TUBLKCBQFVQEOG-SCFUHWHPSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50452202   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50452202
PNG
(CHEMBL2113424)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCCCCC3)ncnc12
Show InChI InChI=1S/C18H27N5O4/c24-8-12-14(25)15(26)18(27-12)23-10-21-13-16(19-9-20-17(13)23)22-11-6-4-2-1-3-5-7-11/h9-12,14-15,18,24-26H,1-8H2,(H,19,20,22)/t12-,14-,15-,18-/m1/s1
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PC cid
PC sid
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Similars

PubMed
4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]CHA from adenosine A1 receptor of rat whole brain


Citation and Details
More data for this
Ligand-Target Pair