Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only
Online Services

I-TASSER I-TASSER-MTD C-I-TASSER CR-I-TASSER QUARK C-QUARK LOMETS MUSTER CEthreader SEGMER DeepFold DeepFoldRNA FoldDesign COFACTOR COACH MetaGO TripletGO IonCom FG-MD ModRefiner REMO DEMO DEMO-EM DMFold SPRING COTH Threpp PEPPI BSpred ANGLOR EDock BSP-SLIM SAXSTER FUpred ThreaDom ThreaDomEx EvoDesign BindProf BindProfX SSIPe GPCR-I-TASSER MAGELLAN ResQ STRUM DAMpred

TM-score TM-align US-align MM-align RNA-align NW-align LS-align EDTSurf MVP MVP-Fit SPICKER HAAD PSSpred 3DRobot MR-REX I-TASSER-MR SVMSEQ NeBcon ResPRE TripletRes DeepPotential WDL-RF ATPbind DockRMSD DeepMSA FASPR EM-Refiner GPU-I-TASSER

BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

You can:

Ligand

NameAC1NJ58P
Molecular formulaC9H13NO3
IUPAC name2-hydroxy-4-[1-hydroxy-2-(methylazaniumyl)ethyl]phenolate
Molecular weight183.207
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP-0.7
Synonyms2-hydroxy-4-[1-hydroxy-2-(methylazaniumyl)ethyl]phenolate
Inchi KeyUCTWMZQNUQWSLP-UHFFFAOYSA-N
Inchi IDInChI=1S/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3
PubChem CID4866774
ChEMBLCHEMBL1740
IUPHAR509
BindingDB84342
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Total entries: 26
Page:  / 2 

GLASS IDNameUniProtGeneSpeciesLength
3337315-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
3337405-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
3337365-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479
5568415-hydroxytryptamine receptor 7P32305Htr7Rattus norvegicus (Rat)448
333730Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
333732Alpha-1A adrenergic receptorP18130ADRA1ABos taurus (Bovine)466
333741Alpha-1A adrenergic receptorQ9WU25ADRA1ACavia porcellus (Guinea pig)466
556844Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
333734Alpha-1B adrenergic receptorP18841ADRA1BMesocricetus auratus (Golden hamster)515
333738Alpha-1B adrenergic receptorP15823Adra1bRattus norvegicus (Rat)515
333727Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
333737Alpha-2A adrenergic receptorQ01338Adra2aMus musculus (Mouse)450
333742Alpha-2A adrenergic receptorP18871ADRA2ASus scrofa (Pig)450
333721Alpha-2B adrenergic receptorP18089ADRA2BHomo sapiens (Human)450
333739Alpha-2B adrenergic receptorO77715ADRA2BDidelphis virginiana (North American opossum)382
333722Alpha-2C adrenergic receptorP18825ADRA2CHomo sapiens (Human)462
333725Alpha-2C adrenergic receptorP22086Adra2cRattus norvegicus (Rat)458
333726Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
333728Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
333729Beta-3 adrenergic receptorP13945ADRB3Homo sapiens (Human)408

zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218