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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	CHEMBL334777
Molecular formula	C32H28N2O4S
IUPAC name	3-[(2R)-5-[4-[(2-phenylbenzoyl)amino]benzoyl]-3,4-dihydro-2H-1,5-benzothiazepin-2-yl]propanoic acid
Molecular weight	536.646
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	6.0
Synonyms	BDBM50135415 3-((R)-5-{4-[(Biphenyl-2-carbonyl)-amino]-benzoyl}-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-2-yl)-propionic acid
Inchi Key	BVJZPAJDRJEDNQ-RUZDIDTESA-N
Inchi ID	InChI=1S/C32H28N2O4S/c35-30(36)19-18-25-20-21-34(28-12-6-7-13-29(28)39-25)32(38)23-14-16-24(17-15-23)33-31(37)27-11-5-4-10-26(27)22-8-2-1-3-9-22/h1-17,25H,18-21H2,(H,33,37)(H,35,36)/t25-/m1/s1
PubChem CID	44352768
ChEMBL	CHEMBL334777
IUPHAR	N/A
BindingDB	50135415
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	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
33815	Vasopressin V1a receptor	P37288	AVPR1A	Homo sapiens (Human)	418
33814	Vasopressin V2 receptor	P30518	AVPR2	Homo sapiens (Human)	371

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