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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	SMR000160396
Molecular formula	C21H18ClN3S2
IUPAC name	2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-4-thiophen-2-yl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile
Molecular weight	411.966
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	4.8
Synonyms	MLS-0315947.0001 2-[(4-chlorobenzyl)sulfanyl]-6-methyl-4-(2-thienyl)-5,6,7,8-tetrahydro[1,6]naphthyridine-3-carbonitrile AKOS003598178 CHEMBL1359342 2-[(4-chlorophenyl)methylthio]-6-methyl-4-(2-thienyl)-5,6,7,8-tetrahydropyridi no[3,2-c]pyridine-3-carbonitrile KS-00003S2V ZINC19597392 387831-24-5 BDBM70650 MLS000545076 2-[(4-chlorobenzyl)thio]-6-methyl-4-(2-thienyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile cid_1201889 SS-0689 2-[(4-chlorophenyl)methylthio]-6-methyl-4-thiophen-2-yl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile MCULE-1666518422 MolPort-002-888-419 2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-4-thiophen-2-yl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile HMS2436F18 ST51023023 2-{[(4-chlorophenyl)methyl]sulfanyl}-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carbonitrile [ Show all ]
Inchi Key	DARZRPCNHBRTOT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H18ClN3S2/c1-25-9-8-18-17(12-25)20(19-3-2-10-26-19)16(11-23)21(24-18)27-13-14-4-6-15(22)7-5-14/h2-7,10H,8-9,12-13H2,1H3
PubChem CID	1201889
ChEMBL	CHEMBL1359342
IUPHAR	N/A
BindingDB	70650
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
55294	Apelin receptor	P35414	APLNR	Homo sapiens (Human)	380
55295	C-C chemokine receptor type 6	P51684	CCR6	Homo sapiens (Human)	374
55293	C-X-C chemokine receptor type 5	P32302	CXCR5	Homo sapiens (Human)	372

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