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Ligand

Name[2-(1-hydroxycyclohexyl)-2-(4-hydroxyphenyl)ethyl]dimethylammonium 3-carboxypropanoate monohydrate
Molecular formulaC20H33NO7
IUPAC name[2-(1-hydroxycyclohexyl)-2-(4-hydroxyphenyl)ethyl]-dimethylazanium;4-hydroxy-4-oxobutanoate;hydrate
Molecular weight399.484
Hydrogen bond acceptor7
Hydrogen bond donor5
XlogPNone
SynonymsN/A
Inchi KeyPWPDEXVGKDEKTE-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H25NO2.C4H6O4.H2O/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16;5-3(6)1-2-4(7)8;/h6-9,15,18-19H,3-5,10-12H2,1-2H3;1-2H2,(H,5,6)(H,7,8);1H2
PubChem CID134715671
ChEMBLN/A
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessPartition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 12
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
270666Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
270670Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
270663Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360
270664D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
270665D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
270667Histamine H1 receptorP30546HRH1Bos taurus (Bovine)491
270669Histamine H2 receptorP47747HRH2Cavia porcellus (Guinea pig)359
270671Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460
270668Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466
270672Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590
270662Muscarinic acetylcholine receptor M4P08173CHRM4Homo sapiens (Human)479
270661Muscarinic acetylcholine receptor M5P08912CHRM5Homo sapiens (Human)532

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