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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	CHEMBL50591
Molecular formula	C24H35N3O
IUPAC name	N-[4-[(2S,7R)-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),11(15),12-trien-4-yl]butyl]cyclohexanecarboxamide
Molecular weight	381.564
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	4.3
Synonyms	SCHEMBL18840699 BDBM50115046 Cyclohexanecarboxylic acid [(6aR,10aS)-4-(4,5,7,8,10,10a-hexahydro-6aH-pyrido[4,3-b]pyrrolo[3,2,1-hi]indol-9-yl)-butyl]-amide N-[4-[(6aR)-4,5,6abeta,7,8,9,10,10abeta-Octahydropyrido[4,3-b]pyrrolo[3,2,1-hi]indole-9-yl]butyl]cyclohexanecarboxamide
Inchi Key	AOIYRGJEOWHRNF-FGZHOGPDSA-N
Inchi ID	InChI=1S/C24H35N3O/c28-24(19-7-2-1-3-8-19)25-13-4-5-14-26-15-12-22-21(17-26)20-10-6-9-18-11-16-27(22)23(18)20/h6,9-10,19,21-22H,1-5,7-8,11-17H2,(H,25,28)/t21-,22-/m1/s1
PubChem CID	44295408
ChEMBL	CHEMBL50591
IUPHAR	N/A
BindingDB	50115046
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
10277	C-C chemokine receptor type 3	P51677	CCR3	Homo sapiens (Human)	355

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