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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	CHEMBL177071
Molecular formula	C34H44F2N4O2
IUPAC name	(2R)-2-[(3S,4S)-3-[[4-[2-ethyl-5-[(2-fluorophenyl)methyl]pyrazol-3-yl]piperidin-1-yl]methyl]-4-(3-fluorophenyl)pyrrolidin-1-yl]-3,3-dimethylbutanoic acid
Molecular weight	578.749
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	4.2
Synonyms	BDBM50141960 (R)-2-[(2S,3S)-3-{4-[2-Ethyl-5-(2-fluoro-benzyl)-2H-pyrazol-3-yl]-piperidin-1-ylmethyl}-4-(3-fluoro-phenyl)-pyrrolidin-1-yl]-3,3-dimethyl-butyric acid
Inchi Key	AMEANAGWRYNMDA-SBAONXBNSA-N
Inchi ID	InChI=1S/C34H44F2N4O2/c1-5-40-31(19-28(37-40)18-25-9-6-7-12-30(25)36)23-13-15-38(16-14-23)20-26-21-39(32(33(41)42)34(2,3)4)22-29(26)24-10-8-11-27(35)17-24/h6-12,17,19,23,26,29,32H,5,13-16,18,20-22H2,1-4H3,(H,41,42)/t26-,29+,32-/m0/s1
PubChem CID	44385583
ChEMBL	CHEMBL177071
IUPHAR	N/A
BindingDB	50141960
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
8789	C-C chemokine receptor type 5	P51681	CCR5	Homo sapiens (Human)	352

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