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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	RS-100235
Molecular formula	C27H35ClN2O5
IUPAC name	1-(5-amino-6-chloro-2,3-dihydro-1,4-benzodioxin-8-yl)-3-[1-[3-(3,4-dimethoxyphenyl)propyl]piperidin-4-yl]propan-1-one
Molecular weight	503.036
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	4.6
Synonyms	i(1/4)(2)i(1/4)(3)a??i(1/4)?i(1/4)?i(1/4)?i(1/4)?i(1/4)?i(1/4)? BDBM85027 PDSP2_001684 1-(5-amino-6-chloro-2,3-dihydro-1,4-benzodioxin-8-yl)-3-[1-[3-(3,4-dimethoxyphenyl)propyl]piperidin-4-yl]propan-1-one D0M5ZE RS100235 L000651 RS 100235 1-(7-Chloro-8-amino-1,4-benzodioxane-5-yl)-3-[1-[3-(3,4-dimethoxyphenyl)propyl]piperidine-4-yl]propane-1-one GTPL250 SCHEMBL13987083 AC1NSKL6 PDSP1_001701 CHEMBL69733 [ Show all ]
Inchi Key	UVOCSZKGWJOKNN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H35ClN2O5/c1-32-23-8-6-19(16-24(23)33-2)4-3-11-30-12-9-18(10-13-30)5-7-22(31)20-17-21(28)25(29)27-26(20)34-14-15-35-27/h6,8,16-18H,3-5,7,9-15,29H2,1-2H3
PubChem CID	5311416
ChEMBL	CHEMBL69733
IUPHAR	250
BindingDB	85027
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
346723	5-hydroxytryptamine receptor 1A	Q64264	Htr1a	Mus musculus (Mouse)	421
346715	5-hydroxytryptamine receptor 2A	P28223	HTR2A	Homo sapiens (Human)	471
346711	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458
346713	5-hydroxytryptamine receptor 4	O70528	HTR4	Cavia porcellus (Guinea pig)	388
346718	5-hydroxytryptamine receptor 4	Q62758	Htr4	Rattus norvegicus (Rat)	406
555009	5-hydroxytryptamine receptor 4	Q13639	HTR4	Homo sapiens (Human)	388
346712	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
346720	Alpha-1B adrenergic receptor	P35368	ADRA1B	Homo sapiens (Human)	520
346708	Alpha-2A adrenergic receptor	P08913	ADRA2A	Homo sapiens (Human)	450
346722	Alpha-2B adrenergic receptor	P18089	ADRA2B	Homo sapiens (Human)	450
346709	D(1A) dopamine receptor	P21728	DRD1	Homo sapiens (Human)	446
346721	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
346717	Muscarinic acetylcholine receptor M1	P11229	CHRM1	Homo sapiens (Human)	460
346714	Muscarinic acetylcholine receptor M2	P08172	CHRM2	Homo sapiens (Human)	466
346710	Muscarinic acetylcholine receptor M3	P20309	CHRM3	Homo sapiens (Human)	590
346707	Type-1 angiotensin II receptor	P30556	AGTR1	Homo sapiens (Human)	359
346719	Type-2 angiotensin II receptor	P50052	AGTR2	Homo sapiens (Human)	363

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