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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	CHEMBL368853
Molecular formula	C29H32FN5O5
IUPAC name	2-[(1R)-1-[[(2S)-2-[(3-fluorophenyl)carbamoylamino]-4-methylpentanoyl]amino]-2-(1-methylindol-3-yl)ethyl]-5-methyl-1,3-oxazole-4-carboxylic acid
Molecular weight	549.603
Hydrogen bond acceptor	7
Hydrogen bond donor	4
XlogP	4.4
Synonyms	SCHEMBL9111130 2-[(R)-1-{(S)-2-[3-(3-Fluoro-phenyl)-ureido]-4-methyl-pentanoylamino}-2-(1-methyl-1H-indol-3-yl)-ethyl]-5-methyl-oxazole-4-carboxylic acid BDBM50050016
Inchi Key	CEZABYWXBHMBEC-XZOQPEGZSA-N
Inchi ID	InChI=1S/C29H32FN5O5/c1-16(2)12-22(33-29(39)31-20-9-7-8-19(30)14-20)26(36)32-23(27-34-25(28(37)38)17(3)40-27)13-18-15-35(4)24-11-6-5-10-21(18)24/h5-11,14-16,22-23H,12-13H2,1-4H3,(H,32,36)(H,37,38)(H2,31,33,39)/t22-,23+/m0/s1
PubChem CID	44386535
ChEMBL	CHEMBL368853
IUPHAR	N/A
BindingDB	50050016
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
40427	Endothelin receptor type B	P35463	EDNRB	Sus scrofa (Pig)	443
40428	Endothelin-1 receptor	P26684	Ednra	Rattus norvegicus (Rat)	426

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