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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	CHEMBL310681
Molecular formula	C31H41N5O7S2
IUPAC name	(4S,7S,13S)-13-[[(2S,3R)-2-amino-3-(4-hydroxyphenyl)butanoyl]amino]-7-benzyl-3,3,14,14-tetramethyl-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-carboxylic acid
Molecular weight	659.817
Hydrogen bond acceptor	10
Hydrogen bond donor	7
XlogP	-0.3
Synonyms	13-[2-Amino-3-(4-hydroxy-phenyl)-butyrylamino]-7-benzyl-3,3,14,14-tetramethyl-6,9,12-trioxo-1,2-dithia-5,8,11-triaza-cyclotetradecane-4-carboxylic acid BDBM50000799
Inchi Key	ABAHQIMHTWGRPU-IPEGHREBSA-N
Inchi ID	InChI=1S/C31H41N5O7S2/c1-17(19-11-13-20(37)14-12-19)23(32)27(40)35-24-28(41)33-16-22(38)34-21(15-18-9-7-6-8-10-18)26(39)36-25(29(42)43)31(4,5)45-44-30(24,2)3/h6-14,17,21,23-25,37H,15-16,32H2,1-5H3,(H,33,41)(H,34,38)(H,35,40)(H,36,39)(H,42,43)/t17-,21+,23+,24+,25+/m1/s1
PubChem CID	44316464
ChEMBL	CHEMBL310681
IUPHAR	N/A
BindingDB	50000799
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. 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
696	Delta-type opioid receptor	P32300	Oprd1	Mus musculus (Mouse)	372
698	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
699	Delta-type opioid receptor	P33533	Oprd1	Rattus norvegicus (Rat)	372
697	Mu-type opioid receptor	P33535	Oprm1	Rattus norvegicus (Rat)	398

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