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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	CHEMBL32745
Molecular formula	C29H34N4O5S
IUPAC name	1-[1-[7-methyl-1-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]indole-5-carbonyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one
Molecular weight	550.674
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	3.2
Synonyms	1-[1-[[1-[[(2R)-1-(Methylsulfonyl)-2-pyrrolidinyl]methyl]-7-methyl-1H-indole-5-yl]carbonyl]-4-piperidinyl]-4H-3,1-benzooxazine-2(1H)-one BDBM50219720
Inchi Key	AUCCRZPRVDTNFD-RUZDIDTESA-N
Inchi ID	InChI=1S/C29H34N4O5S/c1-20-16-23(17-21-9-13-31(27(20)21)18-25-7-5-12-32(25)39(2,36)37)28(34)30-14-10-24(11-15-30)33-26-8-4-3-6-22(26)19-38-29(33)35/h3-4,6,8-9,13,16-17,24-25H,5,7,10-12,14-15,18-19H2,1-2H3/t25-/m1/s1
PubChem CID	44279637
ChEMBL	CHEMBL32745
IUPHAR	N/A
BindingDB	50219720
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
14502	Oxytocin receptor	P30559	OXTR	Homo sapiens (Human)	389

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