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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	CHEMBL505595
Molecular formula	C34H51N5O3
IUPAC name	5-[4-[5-butyl-3-(oxane-4-carbonyl)-3,9-diazaspiro[5.5]undecan-9-yl]-4-methylpiperidine-1-carbonyl]-4,6-dimethylpyridine-2-carbonitrile
Molecular weight	577.814
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	4.7
Synonyms	5-(4-(7-butyl-9-(tetrahydro-2H-pyran-4-carbonyl)-3,9-diazaspiro[5.5]undecan-3-yl)-4-methylpiperidine-1-carbonyl)-4,6-dimethylpicolinonitrile BDBM50254672 SCHEMBL4123857 5-[4-[11-butyl-9-(tetrahydropyran-4-carbonyl)-3,9-diazaspiro[5.5]undecan-3-yl]-4-methyl-piperidine-1-carbonyl]-4,6-dimethyl-pyridine-2-carbonitrile
Inchi Key	ANPTZVJWLKOADS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C34H51N5O3/c1-5-6-7-28-24-38(31(40)27-8-20-42-21-9-27)17-12-34(28)13-18-39(19-14-34)33(4)10-15-37(16-11-33)32(41)30-25(2)22-29(23-35)36-26(30)3/h22,27-28H,5-21,24H2,1-4H3
PubChem CID	25230770
ChEMBL	CHEMBL505595
IUPHAR	N/A
BindingDB	50254672
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
9768	C-C chemokine receptor type 5	P51681	CCR5	Homo sapiens (Human)	352

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