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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	CHEMBL1076624
Molecular formula	C34H44F2N4O6
IUPAC name	[(4S,4aS,8aR)-2-[(2S)-3-(6-methoxypyridin-3-yl)-2-methylpropyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-4-yl]-[4-(3,4-difluorophenyl)piperazin-1-yl]methanone;(E)-but-2-enedioic acid
Molecular weight	642.745
Hydrogen bond acceptor	11
Hydrogen bond donor	2
XlogP	None
Synonyms	N/A
Inchi Key	SCJCAKLZCWCCCO-HTCZGZADSA-N
Inchi ID	InChI=1S/C30H40F2N4O2.C4H4O4/c1-21(15-22-7-10-29(38-2)33-17-22)18-34-19-23-5-3-4-6-25(23)26(20-34)30(37)36-13-11-35(12-14-36)24-8-9-27(31)28(32)16-24;5-3(6)1-2-4(7)8/h7-10,16-17,21,23,25-26H,3-6,11-15,18-20H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t21-,23-,25-,26+;/m0./s1
PubChem CID	46880586
ChEMBL	CHEMBL1076624
IUPHAR	N/A
BindingDB	N/A
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. Partition coefficient log P of this ligand is not available.

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
310855	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458
310851	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
310857	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
310847	Somatostatin receptor type 1	P28646	Sstr1	Rattus norvegicus (Rat)	391
310856	Somatostatin receptor type 1	P30872	SSTR1	Homo sapiens (Human)	391
310849	Somatostatin receptor type 2	P30874	SSTR2	Homo sapiens (Human)	369
310852	Somatostatin receptor type 2	P30680	Sstr2	Rattus norvegicus (Rat)	369
310850	Somatostatin receptor type 3	P32745	SSTR3	Homo sapiens (Human)	418
310854	Somatostatin receptor type 3	P30935	Sstr3	Mus musculus (Mouse)	428
310848	Somatostatin receptor type 4	P31391	SSTR4	Homo sapiens (Human)	388
310853	Somatostatin receptor type 5	P35346	SSTR5	Homo sapiens (Human)	364

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