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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	CHEMBL63790
Molecular formula	C21H20N4O2S
IUPAC name	8-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaene
Molecular weight	392.477
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	4.4
Synonyms	BDBM50407790
Inchi Key	IURWVMMKDXJLTR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H20N4O2S/c1-2-17-20(22-16-5-11-28-21(16)25(17)6-1)24-9-7-23(8-10-24)13-15-3-4-18-19(12-15)27-14-26-18/h1-6,11-12H,7-10,13-14H2
PubChem CID	11794853
ChEMBL	CHEMBL63790
IUPHAR	N/A
BindingDB	50407790
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
142302	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
142298	5-hydroxytryptamine receptor 1B	P28564	Htr1b	Rattus norvegicus (Rat)	386
142300	5-hydroxytryptamine receptor 1D	P79400	HTR1D	Sus scrofa (Pig)	291
142301	5-hydroxytryptamine receptor 2A	Q75Z89	HTR2A	Bos taurus (Bovine)	470
142299	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458

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