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Ligand

NameCHEMBL545362
Molecular formulaC23H35ClN6O4S
IUPAC nameN-[4-(dimethylamino)butyl]-4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)benzenesulfonamide;hydrochloride
Molecular weight527.081
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogPNone
SynonymsN/A
Inchi KeyBVTCNCRRSMRDJE-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H34N6O4S.ClH/c1-5-14-28-21-19(22(30)29(15-6-2)23(28)31)25-20(26-21)17-9-11-18(12-10-17)34(32,33)24-13-7-8-16-27(3)4;/h9-12,24H,5-8,13-16H2,1-4H3,(H,25,26);1H
PubChem CID13525080
ChEMBLCHEMBL545362
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
34042Adenosine receptor A1P28190ADORA1Bos taurus (Bovine)326
34043Adenosine receptor A1P25099Adora1Rattus norvegicus (Rat)326

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