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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	CHEMBL464509
Molecular formula	C20H23N5O2S
IUPAC name	2-hydroxy-N,N-dimethyl-3-[[4-[[(1R)-1-phenylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]benzamide
Molecular weight	397.497
Hydrogen bond acceptor	7
Hydrogen bond donor	3
XlogP	4.6
Synonyms	SCHEMBL13208124 BDBM50248547 N,N-Dimethyl-2-hydroxy-3-[4-[[(R)-1-phenylpropyl]amino]-1,2,5-thiadiazole-3-ylamino]benzamide (R)-2-hydroxy-N,N-dimethyl-3-(4-(1-phenylpropylamino)-1,2,5-thiadiazol-3-ylamino)benzamide
Inchi Key	BIKNKROBNQQGKU-OAHLLOKOSA-N
Inchi ID	InChI=1S/C20H23N5O2S/c1-4-15(13-9-6-5-7-10-13)21-18-19(24-28-23-18)22-16-12-8-11-14(17(16)26)20(27)25(2)3/h5-12,15,26H,4H2,1-3H3,(H,21,23)(H,22,24)/t15-/m1/s1
PubChem CID	135814570
ChEMBL	CHEMBL464509
IUPHAR	N/A
BindingDB	50248547
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

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
558028	C-X-C chemokine receptor type 1	P25024	CXCR1	Homo sapiens (Human)	350
558027	C-X-C chemokine receptor type 2	P25025	CXCR2	Homo sapiens (Human)	360

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