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GLASS

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

Name	Vasoactive intestinal polypeptide receptor 2
Species	Homo sapiens (Human)
Gene	VIPR2
Synonym	VPAC2 VIP-R-2 VIP and PACAP receptor 2 PVR3 Pituitary adenylate cyclase-activating polypeptide type III receptor PACAP-R3 PACAP-R-3 PACAP type III receptor Helodermin-preferring VIP receptor VPAC2 receptor [ Show all ]
Disease	Unspecified Chronic obstructive pulmonary disease Hypertension
Length	438
Amino acid sequence	MRTLLPPALLTCWLLAPVNSIHPECRFHLEIQEEETKCAELLRSQTEKHKACSGVWDNITCWRPANVGETVTVPCPKVFSNFYSKAGNISKNCTSDGWSETFPDFVDACGYSDPEDESKITFYILVKAIYTLGYSVSLMSLATGSIILCLFRKLHCTRNYIHLNLFLSFILRAISVLVKDDVLYSSSGTLHCPDQPSSWVGCKLSLVFLQYCIMANFFWLLVEGLYLHTLLVAMLPPRRCFLAYLLIGWGLPTVCIGAWTAARLYLEDTGCWDTNDHSVPWWVIRIPILISIIVNFVLFISIIRILLQKLTSPDVGGNDQSQYKRLAKSTLLLIPLFGVHYMVFAVFPISISSKYQILFELCLGSFQGLVVAVLYCFLNSEVQCELKRKWRSRCPTPSASRDYRVCGSSFSRNGSEGALQFHRGSRAQSFLQTETSVI
UniProt	P41587
Protein Data Bank	N/A
GPCR-HGmod model	P41587
3D structure model	This predicted structure model is from GPCR-EXP P41587.
BioLiP	N/A
Therapeutic Target Database	T06182
ChEMBL	CHEMBL4532
IUPHAR	372
DrugBank	N/A

Ligand

Name	CHEMBL3913678
Molecular formula	C23H27ClN2O4
IUPAC name	(2R,4S)-2-benzyl-5-[(2-chloroacetyl)amino]-4-hydroxy-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]pentanamide
Molecular weight	430.929
Hydrogen bond acceptor	4
Hydrogen bond donor	4
XlogP	2.1
Synonyms	SCHEMBL17038237
Inchi Key	OLEINWHPOSEZNI-MXKPZRPRSA-N
Inchi ID	InChI=1S/C23H27ClN2O4/c24-13-21(29)25-14-18(27)11-17(10-15-6-2-1-3-7-15)23(30)26-22-19-9-5-4-8-16(19)12-20(22)28/h1-9,17-18,20,22,27-28H,10-14H2,(H,25,29)(H,26,30)/t17-,18+,20-,22+/m1/s1
PubChem CID	118334885
ChEMBL	CHEMBL3913678
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Inhibition	9.9 %	None	ChEMBL
Inhibition	15.6 %	None	ChEMBL
Inhibition	17.5 %	None	ChEMBL
Inhibition	18.4 %	None	ChEMBL
Inhibition	19.2 %	None	ChEMBL
Inhibition	23.7 %	None	ChEMBL

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