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 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

Nameatenolol
Molecular formulaC14H22N2O3
IUPAC name2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide
Molecular weight266.341
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP0.2
SynonymsST2403914
Tenoprin
Tox21_302426
Wesipin
Prenolol
[ Show all ]
Inchi KeyMETKIMKYRPQLGS-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)
PubChem CID2249
ChEMBLCHEMBL24
IUPHAR548
BindingDB25753
DrugBankDB00335

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 13
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2036895-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
2036905-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
2036875-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
449704Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318
203685Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
203686Beta-1 adrenergic receptorP18090Adrb1Rattus norvegicus (Rat)466
203684Beta-2 adrenergic receptorQ8K4Z4Adrb2Cavia porcellus (Guinea pig)418
203688Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
203693Beta-2 adrenergic receptorP54833ADRB2Canis lupus familiaris (Dog)415
461009Beta-2 adrenergic receptorP10608Adrb2Rattus norvegicus (Rat)418
203691Beta-3 adrenergic receptorP13945ADRB3Homo sapiens (Human)408
203692D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
556289D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444

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