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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	CHEMBL331037
Molecular formula	C27H37N5O4S
IUPAC name	N-[4-[4-[6-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]hexanoyl]piperazin-1-yl]phenyl]methanesulfonamide
Molecular weight	527.684
Hydrogen bond acceptor	7
Hydrogen bond donor	3
XlogP	2.4
Synonyms	BDBM50033429 L014159 1-[4-[4-[(Methylsulfonyl)amino]phenyl]piperazin-1-yl]-6-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-1-hexanone N-[4-(4-{6-[3-(2-Amino-ethyl)-1H-indol-5-yloxy]-hexanoyl}-piperazin-1-yl)-phenyl]-methanesulfonamide SCHEMBL6601544
Inchi Key	AQUSECISJGGKTA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H37N5O4S/c1-37(34,35)30-22-6-8-23(9-7-22)31-14-16-32(17-15-31)27(33)5-3-2-4-18-36-24-10-11-26-25(19-24)21(12-13-28)20-29-26/h6-11,19-20,29-30H,2-5,12-18,28H2,1H3
PubChem CID	10324625
ChEMBL	CHEMBL331037
IUPHAR	N/A
BindingDB	50033429
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
12120	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
12121	5-hydroxytryptamine receptor 1D	P28221	HTR1D	Homo sapiens (Human)	377

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