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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	CHEMBL127411
Molecular formula	C20H22N2O3S
IUPAC name	(4S,5S)-4-(dimethylamino)-1-(4-methylphenyl)sulfonyl-4,5-dihydro-3H-benzo[cd]indol-5-ol
Molecular weight	370.467
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	2.9
Synonyms	(4S,5S)-4-Dimethylamino-1-(toluene-4-sulfonyl)-1,3,4,5-tetrahydro-benzo[cd]indol-5-ol 1-Tosyl-4alpha-(dimethylamino)-1,3,4,5-tetrahydrobenzo[cd]indole-5beta-ol BDBM50106248 SCHEMBL7430504 4-Dimethylamino-1-(toluene-4-sulfonyl)-1,3,4,5-tetrahydro-benzo[cd]indol-5-ol
Inchi Key	OVDROBGSEQOKQB-ICSRJNTNSA-N
Inchi ID	InChI=1S/C20H22N2O3S/c1-13-7-9-15(10-8-13)26(24,25)22-12-14-11-18(21(2)3)20(23)16-5-4-6-17(22)19(14)16/h4-10,12,18,20,23H,11H2,1-3H3/t18-,20-/m0/s1
PubChem CID	6918601
ChEMBL	CHEMBL127411
IUPHAR	N/A
BindingDB	50106248
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
251090	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
251098	5-hydroxytryptamine receptor 1B	P28222	HTR1B	Homo sapiens (Human)	390
251089	5-hydroxytryptamine receptor 1D	P28221	HTR1D	Homo sapiens (Human)	377
251096	5-hydroxytryptamine receptor 2A	P14842	Htr2a	Rattus norvegicus (Rat)	471
251091	5-hydroxytryptamine receptor 5A	P35364	Htr5a	Rattus norvegicus (Rat)	357
251092	5-hydroxytryptamine receptor 6	P50406	HTR6	Homo sapiens (Human)	440
251093	5-hydroxytryptamine receptor 7	P34969	HTR7	Homo sapiens (Human)	479
251097	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
251095	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
251094	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467

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