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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	CHEMBL3609619
Molecular formula	C32H30F6N4O5
IUPAC name	[3,5-bis(trifluoromethyl)phenyl]methyl (2S)-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoate
Molecular weight	664.605
Hydrogen bond acceptor	12
Hydrogen bond donor	5
XlogP	4.5
Synonyms	N/A
Inchi Key	ADPQCWUGLGBPRO-ISCRSJHHSA-N
Inchi ID	InChI=1S/C32H30F6N4O5/c1-17(41-29(45)25(39)12-18-6-8-23(43)9-7-18)28(44)42-27(13-20-15-40-26-5-3-2-4-24(20)26)30(46)47-16-19-10-21(31(33,34)35)14-22(11-19)32(36,37)38/h2-11,14-15,17,25,27,40,43H,12-13,16,39H2,1H3,(H,41,45)(H,42,44)/t17-,25+,27+/m1/s1
PubChem CID	44176458
ChEMBL	CHEMBL3609619
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.

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
463226	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
463230	Delta-type opioid receptor	P32300	Oprd1	Mus musculus (Mouse)	372
463227	Mu-type opioid receptor	P33535	Oprm1	Rattus norvegicus (Rat)	398
463231	Mu-type opioid receptor	P97266	OPRM1	Cavia porcellus (Guinea pig)	98
463228	Substance-P receptor	P25103	TACR1	Homo sapiens (Human)	407
463229	Substance-P receptor	P30547	TACR1	Cavia porcellus (Guinea pig)	407
463232	Substance-P receptor	P14600	Tacr1	Rattus norvegicus (Rat)	407

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