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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	CHEMBL574534
Molecular formula	C62H70N12O4
IUPAC name	N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-4-[1-[[4-[4-[[4-[4-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butylcarbamoyl]phenyl]triazol-1-yl]methyl]phenyl]phenyl]methyl]triazol-4-yl]benzamide
Molecular weight	1047.32
Hydrogen bond acceptor	12
Hydrogen bond donor	2
XlogP	8.8
Synonyms	BDBM50299412 4,4'-[(Biphenyl-4,4'-diyl)bis[methylene(1H-1,2,3-triazole-1,4-diyl)]]bis[N-[4-[4-(2-methoxyphenyl)piperazino]butyl]benzamide] 4,4''-[Biphenyl-4,4''-diylbis(methylene-1H-1,2,3-triazole-1,4-diyl)]bis(N-{4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl}benzamide)
Inchi Key	KEOJOHYWCQCCER-UHFFFAOYSA-N
Inchi ID	InChI=1S/C62H70N12O4/c1-77-59-13-5-3-11-57(59)71-39-35-69(36-40-71)33-9-7-31-63-61(75)53-27-23-51(24-28-53)55-45-73(67-65-55)43-47-15-19-49(20-16-47)50-21-17-48(18-22-50)44-74-46-56(66-68-74)52-25-29-54(30-26-52)62(76)64-32-8-10-34-70-37-41-72(42-38-70)58-12-4-6-14-60(58)78-2/h3-6,11-30,45-46H,7-10,31-44H2,1-2H3,(H,63,75)(H,64,76)
PubChem CID	45483655
ChEMBL	CHEMBL574534
IUPHAR	N/A
BindingDB	50299412
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
167270	5-hydroxytryptamine receptor 2A	P50129	HTR2A	Sus scrofa (Pig)	470
167273	D(1A) dopamine receptor	P50130	DRD1	Sus scrofa (Pig)	446
167271	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
167272	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
526268	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467

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