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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	CGS 12066B
Molecular formula	C17H17F3N4
IUPAC name	4-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline
Molecular weight	334.346
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	4.0
Synonyms	CHEMBL27403 Lopac0_000332 NCGC00024701-01 UNII-5TB4SXQ7HG 4-(4-Methyl-1-piperazinyl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline # BDBM81497 CGS 12066B-parent DTXSID3043730 NCGC00015180-01 NSC_123945 5TB4SXQ7HG BRD-K18909381-001-01-4 CGS-12066A maleate salt CHEBI:64055 L000723 NCGC00015180-04 SCHEMBL1660466 109028-09-3 Cgs 12066 CTK6I3092 LS-187235 NCGC00024701-02 ZINC2516018 4-(4-Methyl-piperazin-1-yl)-7-trifluoromethyl-pyrrolo[1,2-a]quinoxaline Biomol-NT_000089 CGS-12066 FT-0708356 NCGC00015180-02 Pyrrolo(1,2-a)quinoxaline, 4-(4-methyl-1-piperazinyl)-7-(trifluoromethyl)- 7-Trifluoromethyl-4-(4-methyl-1-piperazinyl)pyrrolo-[1,2-a]quinoxaline maleate salt CAS_109028-10-6 CGS-12066B Lopac-C-106 NCGC00015180-05 Tocris-0638 109028-10-6 AC1L1E8Q D0Q1ER LXFHSCDLMBZYKY-UHFFFAOYSA-N NCGC00024701-03 4-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline BPBio1_001091 CGS-12066A GTPL109 NCGC00015180-03 Pyrrolo[1,2-a]quinoxaline, 4-(4-methyl-1-piperazinyl)-7-(trifluoromethyl)- 7-trifluoromethyl-4-(4-methyl-1-piperazinyl)pyrrolo[1,2-a]quinoxaline CCG-204427 CGS12066 [ Show all ]
Inchi Key	LXFHSCDLMBZYKY-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H17F3N4/c1-22-7-9-23(10-8-22)16-15-3-2-6-24(15)14-5-4-12(17(18,19)20)11-13(14)21-16/h2-6,11H,7-10H2,1H3
PubChem CID	2689
ChEMBL	CHEMBL27403
IUPHAR	109
BindingDB	81497
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
198695	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
198699	5-hydroxytryptamine receptor 1A	P19327	Htr1a	Rattus norvegicus (Rat)	422
198688	5-hydroxytryptamine receptor 1B	P28222	HTR1B	Homo sapiens (Human)	390
198691	5-hydroxytryptamine receptor 1B	P28564	Htr1b	Rattus norvegicus (Rat)	386
198690	5-hydroxytryptamine receptor 1D	P28221	HTR1D	Homo sapiens (Human)	377
198692	5-hydroxytryptamine receptor 1D	P28565	Htr1d	Rattus norvegicus (Rat)	374
198702	5-hydroxytryptamine receptor 1D	P79400	HTR1D	Sus scrofa (Pig)	291
198697	5-hydroxytryptamine receptor 2A	P28223	HTR2A	Homo sapiens (Human)	471
198701	5-hydroxytryptamine receptor 2A	Q75Z89	HTR2A	Bos taurus (Bovine)	470
556267	5-hydroxytryptamine receptor 2A	P14842	Htr2a	Rattus norvegicus (Rat)	471
198694	5-hydroxytryptamine receptor 2B	P41595	HTR2B	Homo sapiens (Human)	481
198696	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458
198700	5-hydroxytryptamine receptor 2C	P08909	Htr2c	Rattus norvegicus (Rat)	460
198693	5-hydroxytryptamine receptor 6	P31388	Htr6	Rattus norvegicus (Rat)	436
198689	D(1A) dopamine receptor	P21728	DRD1	Homo sapiens (Human)	446
556268	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
556266	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
198698	Thyrotropin receptor	P16473	TSHR	Homo sapiens (Human)	764

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