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Ligand

NameSCHEMBL1497826
Molecular formulaC22H20Cl3N3OS
IUPAC name[2-amino-4-[[4-(3,5-dichlorophenyl)piperazin-1-yl]methyl]thiophen-3-yl]-(4-chlorophenyl)methanone
Molecular weight480.832
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP6.5
SynonymsCHEMBL1934873
Inchi KeyACGNVIYHWCNNLW-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H20Cl3N3OS/c23-16-3-1-14(2-4-16)21(29)20-15(13-30-22(20)26)12-27-5-7-28(8-6-27)19-10-17(24)9-18(25)11-19/h1-4,9-11,13H,5-8,12,26H2
PubChem CID25068826
ChEMBLCHEMBL1934873
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1546Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
441727Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
441726Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318

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