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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	C-X-C chemokine receptor type 3
Species	Mus musculus (Mouse)
Gene	Cxcr3
Synonym	IP-10 receptor Interferon-inducible protein 10 receptor GPR9 G protein-coupled receptor 9 CXCR3 CXCR-3 CXC-R3 CKR-L2 chemokine (C-X-C motif) receptor 3 CD183 MigR [ Show all ]
Disease	N/A for non-human GPCRs
Length	367
Amino acid sequence	MYLEVSERQVLDASDFAFLLENSTSPYDYGENESDFSDSPPCPQDFSLNFDRTFLPALYSLLFLLGLLGNGAVAAVLLSQRTALSSTDTFLLHLAVADVLLVLTLPLWAVDAAVQWVFGPGLCKVAGALFNINFYAGAFLLACISFDRYLSIVHATQIYRRDPRVRVALTCIVVWGLCLLFALPDFIYLSANYDQRLNATHCQYNFPQVGRTALRVLQLVAGFLLPLLVMAYCYAHILAVLLVSRGQRRFRAMRLVVVVVAAFAVCWTPYHLVVLVDILMDVGVLARNCGRESHVDVAKSVTSGMGYMHCCLNPLLYAFVGVKFREQMWMLFTRLGRSDQRGPQRQPSSSRRESSWSETTEASYLGL
UniProt	O88410
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL5200
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL1809006
Molecular formula	C27H29N5O2
IUPAC name	(6aR,9R)-9-(4-methylpiperazine-1-carbonyl)-N-phenyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7-carboxamide
Molecular weight	455.562
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	2.2
Synonyms	BDBM50349647
Inchi Key	CVGQIJAZGUTYJV-NTKDMRAZSA-N
Inchi ID	InChI=1S/C27H29N5O2/c1-30-10-12-31(13-11-30)26(33)19-14-22-21-8-5-9-23-25(21)18(16-28-23)15-24(22)32(17-19)27(34)29-20-6-3-2-4-7-20/h2-9,14,16,19,24,28H,10-13,15,17H2,1H3,(H,29,34)/t19-,24-/m1/s1
PubChem CID	56673938
ChEMBL	CHEMBL1809006
IUPHAR	N/A
BindingDB	50349647
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	112.0 nM	PMID21764306	BindingDB,ChEMBL

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