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GLASS

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

Name	Hydroxycarboxylic acid receptor 3
Species	Homo sapiens (Human)
Gene	HCAR3
Synonym	G-protein coupled receptor 109B Nicotinic acid receptor 2 Nic2 NIACR2 Niacin receptor 2 Low affinity nicotinic acid receptor G protein-coupled receptor 109B G-protein coupled receptor HM74B G-protein coupled receptor HM74 HCA3 receptor [ Show all ]
Disease	N/A
Length	387
Amino acid sequence	MNRHHLQDHFLEIDKKNCCVFRDDFIAKVLPPVLGLEFIFGLLGNGLALWIFCFHLKSWKSSRIFLFNLAVADFLLIICLPFVMDYYVRRSDWKFGDIPCRLVLFMFAMNRQGSIIFLTVVAVDRYFRVVHPHHALNKISNWTAAIISCLLWGITVGLTVHLLKKKLLIQNGTANVCISFSICHTFRWHEAMFLLEFFLPLGIILFCSARIIWSLRQRQMDRHAKIKRAITFIMVVAIVFVICFLPSVVVRIHIFWLLHTSGTQNCEVYRSVDLAFFITLSFTYMNSMLDPVVYYFSSPSFPNFFSTLINRCLQRKITGEPDNNRSTSVELTGDPNKTRGAPEALIANSGEPWSPSYLGPTSNNHSKKGHCHQEPASLEKQLGCCIE
UniProt	P49019
Protein Data Bank	N/A
GPCR-HGmod model	P49019
3D structure model	This predicted structure model is from GPCR-EXP P49019.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL4421
IUPHAR	313
DrugBank	BE0000836

Ligand

Name	5-isopropyl-1H-pyrazole-3-carboxylic acid
Molecular formula	C7H10N2O2
IUPAC name	5-propan-2-yl-1H-pyrazole-3-carboxylic acid
Molecular weight	154.169
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	1.2
Synonyms	BS-3854 D0IC7C HMS2480B08 MFCD05170240 RT-010352 1H-Pyrazole-3-carboxylic acid, 5-(1-methylethyl)- STK501183 5-(1-methylethyl)-1H-pyrazole-3-carboxylic acid 5-propan-2-yl-1H-pyrazole-3-carboxylic acid AC1Q1OGL AKOS002436024 ChemDiv2_003364 F0917-7551 KB-88190 MolPort-003-748-659 SMR000124646 3-(propan-2-yl)-1H-pyrazole-5-carboxylic acid Y4730 92933-47-6 ACMC-20cbo3 BAS 15375081 BC262244 CTK5G2493 FT-0642232 MCULE-7390245939 PubChem22754 ST2406290 3-Isopropylpyrazole-5-carboxylic acid, 97% 5-isopropylpyrazol-3-carboxylic acid AB11579 AK-36894 DB-011449 I11-0345 MLS000067212 SBB010346 1H-Pyrazole-5-carboxylic acid, 3-(1-methylethyl)- TR-042750 5-(propan-2-yl)-1H-pyrazole-3-carboxylic acid AC1Q1OYW AKOS025394901 BB 0219317 CHWXKAHFWLSLOQ-UHFFFAOYSA-N FC0632 KS-00000K8K Oprea1_070012 SR-01000597148 3-isopropyl-1H-pyrazole-5-carboxylic acid Z425389704 5-Isopropyl-2H-pyrazole-3-carboxylic acid A1-00182 ACN-P001039 BDBM50211363 CTK5H1901 HMS1378I20 MFCD02224142 RP00176 ST4140384 4CH-000753 5-ISOPROPYLPYRAZOLE-3-CARBOXYLIC ACID AC1LFDP2 AKOS000271363 CHEMBL238002 EN300-41163 J-517652 MolPort-000-183-309 SCHEMBL1739326 3-(methylethyl)pyrazole-5-carboxylic acid Y-1630 5-isopropyl-1H-pyrazol-3-carboxylic acid 890590-91-7 AC1Q5UGZ ALBB-005265 BBL008246 CS-W006370 FT-0083394 L-2002 Oprea1_115867 SR-01000597148-1 3-Isopropylpyrazole-5-carboxylic acid ZINC5686012 5-isopropyl-3-carboxyl-pyrazole AB0037446 AJ-70741 [ Show all ]
Inchi Key	CHWXKAHFWLSLOQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C7H10N2O2/c1-4(2)5-3-6(7(10)11)9-8-5/h3-4H,1-2H3,(H,8,9)(H,10,11)
PubChem CID	776421
ChEMBL	CHEMBL238002
IUPHAR	N/A
BindingDB	50211363
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	41686.9 nM	PMID17804224	ChEMBL
EC50	41687.0 nM	PMID17804224	BindingDB

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