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GLASS

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

Name	Substance-K receptor
Species	Mesocricetus auratus (Golden hamster)
Gene	TACR2
Synonym	Neurokinin A receptor NK-2 receptor NK-2R SKR Tachykinin receptor 2
Disease	N/A for non-human GPCRs
Length	384
Amino acid sequence	MGGRAIVTDTNIFSGLESNTTGVTAFSMPAWQLALWATAYLGLVLVAVTGNATVIWIILAHERMRTVTNYFIINLALADLCMAAFNATFNFVYASHNIWYFGRAFCYFQNLFPITAMFVSIYSMTAIAADRYMAIVHPFQPRLSAPITKATIAGIWLVALALASPQCFYSTITVDQGATKCVVAWPNDNGGKMLLLYHLVVFVLVYFLPLVVMFVAYSVIGLTLWKRAVPRHQAHGANLRHLHAKKKFVKAMVLVVLTFAICWLPYHLYFILGSFQKDIYYRKFIQQVYLALFWLAMSSTMYNPIIYCCLNHRFRSGFRLAFRCCPWVTPTEEDRLELTRTPSLSRRVNRCHTKETLFMTADMTHSEATNGQVGSPQDVEPAAP
UniProt	P51144
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	CHEMBL2304405
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL118328
Molecular formula	C20H22N4O2
IUPAC name	(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropanamide
Molecular weight	350.422
Hydrogen bond acceptor	3
Hydrogen bond donor	4
XlogP	0.8
Synonyms	BDBM50289293 1N-[1-carbamoyl-2-phenyl-(1S)-ethyl]-2-amino-3-(1H-3-indolyl)-(2S)-propanamide
Inchi Key	CIZAZGNGSGBRIV-WMZOPIPTSA-N
Inchi ID	InChI=1S/C20H22N4O2/c21-16(11-14-12-23-17-9-5-4-8-15(14)17)20(26)24-18(19(22)25)10-13-6-2-1-3-7-13/h1-9,12,16,18,23H,10-11,21H2,(H2,22,25)(H,24,26)/t16-,18-/m0/s1
PubChem CID	44345938
ChEMBL	CHEMBL118328
IUPHAR	N/A
BindingDB	50289293
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	5200.0 nM	, Bioorg. Med. Chem. Lett., (1997) 7:1:31	BindingDB,ChEMBL

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