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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	MLS000724783
Molecular formula	C18H18ClF2N3O2S2
IUPAC name	4-(3-chlorophenyl)-N-[3-(difluoromethylsulfonyl)phenyl]piperazine-1-carbothioamide
Molecular weight	445.928
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	4.1
Synonyms	4-(3-chlorophenyl)-N-{3-[(difluoromethyl)sulfonyl]phenyl}piperazine-1-carbothioamide cid_2147112 ST50777176 AC1M2MFU MCULE-9967929023 {[3-({[4-(3-chlorophenyl)piperazinyl]thioxomethyl}amino)phenyl]sulfonyl}difluo romethane 4-(3-chlorophenyl)-N-[3-(difluoromethylsulfonyl)phenyl]-1-piperazinecarbothioamide N-[3-[bis(fluoranyl)methylsulfonyl]phenyl]-4-(3-chlorophenyl)piperazine-1-carbothioamide F1743-0022 STK807724 AKOS000809899 4-(3-chlorophenyl)-N-[3-(difluoromethylsulfonyl)phenyl]piperazine-1-carbothioamide CHEMBL1388940 SMR000236945 690249-48-0 HMS2592G04 ZINC2709006 4-(3-chlorophenyl)-N-(3-((difluoromethyl)sulfonyl)phenyl)piperazine-1-carbothioamide BDBM61810 MolPort-000-380-038 [ Show all ]
Inchi Key	AFYSBOFSBZXDRD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H18ClF2N3O2S2/c19-13-3-1-5-15(11-13)23-7-9-24(10-8-23)18(27)22-14-4-2-6-16(12-14)28(25,26)17(20)21/h1-6,11-12,17H,7-10H2,(H,22,27)
PubChem CID	2147112
ChEMBL	CHEMBL1388940
IUPHAR	N/A
BindingDB	61810
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
4627	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
4628	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371
4629	Neuropeptide Y receptor type 1	P25929	NPY1R	Homo sapiens (Human)	384
4630	Neuropeptide Y receptor type 2	P49146	NPY2R	Homo sapiens (Human)	381
463446	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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