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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 39604
Molecular formula	C26H36ClN3O6S
IUPAC name	N-[2-[4-[3-[4-amino-5-chloro-2-[(3,5-dimethoxyphenyl)methoxy]phenyl]-3-oxopropyl]piperidin-1-yl]ethyl]methanesulfonamide
Molecular weight	554.099
Hydrogen bond acceptor	9
Hydrogen bond donor	2
XlogP	3.1
Synonyms	BRD2498 Methanesulfonamide, N-(2-(4-(3-(4-amino-5-chloro-2-((3,5-dimethoxyphenyl)methoxy)phenyl)-3-oxopropyl)-1-piperidinyl)ethyl)- SCHEMBL2946020 AC1NOXR2 NCGC00024922-02 ZINC26267226 Biomol-NT_000149 GNF-Pf-5475 161362-65-8 BRD-K20742498-001-01-5 CAS_167710-87-4 N-[2-[4-[3-[4-amino-5-chloro-2-[(3,5-dimethoxyphenyl)methoxy]phenyl]-3-oxopropyl]piperidin-1-yl]ethyl]methanesulfonamide Tocris-0991 BDBM82273 CHEMBL66114 PDSP1_001669 BPBio1_000573 L011797 RS-39604 BRD-K20742498-003-01-1 CHEBI:64083 NCGC00024922-01 UNII-0RP0I19CSC beta-[1-[2-(Methylsulfonylamino)ethyl]-4-piperidinyl]-4'-amino-5'-chloro-2'-(3,5-dimethoxybenzyloxy)propiophenone DTXSID0043898 PDSP2_001653 0RP0I19CSC BRD-2498 [ Show all ]
Inchi Key	BKVIWGRFRKLFIO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H36ClN3O6S/c1-34-20-12-19(13-21(14-20)35-2)17-36-26-16-24(28)23(27)15-22(26)25(31)5-4-18-6-9-30(10-7-18)11-8-29-37(3,32)33/h12-16,18,29H,4-11,17,28H2,1-3H3
PubChem CID	5145950
ChEMBL	CHEMBL66114
IUPHAR	N/A
BindingDB	82273
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
26203	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458
26201	5-hydroxytryptamine receptor 4	O70528	HTR4	Cavia porcellus (Guinea pig)	388
26204	5-hydroxytryptamine receptor 4	Q62758	Htr4	Rattus norvegicus (Rat)	406
555589	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
26205	B1 bradykinin receptor	P46663	BDKRB1	Homo sapiens (Human)	353
26206	D(1A) dopamine receptor	P21728	DRD1	Homo sapiens (Human)	446
555588	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
459445	Mu-type opioid receptor	P33535	Oprm1	Rattus norvegicus (Rat)	398
26202	Muscarinic acetylcholine receptor M1	P11229	CHRM1	Homo sapiens (Human)	460
26207	Muscarinic acetylcholine receptor M2	P08172	CHRM2	Homo sapiens (Human)	466

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