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

Namehaloperidol
Molecular formulaC21H23ClFNO2
IUPAC name4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(4-fluorophenyl)butan-1-one
Molecular weight375.868
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.2
SynonymsSC 170973
Sernas
Spectrum2_001268
SR-01000003076-8
Tox21_500583
[ Show all ]
Inchi KeyLNEPOXFFQSENCJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
PubChem CID3559
ChEMBLCHEMBL54
IUPHAR86
BindingDB21398
DrugBankDB00502

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 88
Page:  / 5 

GLASS IDNameUniProtGeneSpeciesLength
1915415-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
1915865-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
1915335-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
1915445-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
1915845-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
1916135-hydroxytryptamine receptor 1DP79400HTR1DSus scrofa (Pig)291
1916045-hydroxytryptamine receptor 1EP28566HTR1EHomo sapiens (Human)365
1916125-hydroxytryptamine receptor 1FP30939HTR1FHomo sapiens (Human)366
1915365-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
1915455-hydroxytryptamine receptor 2AP50129HTR2ASus scrofa (Pig)470
1915475-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
1915955-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
1915605-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
1915405-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
1915595-hydroxytryptamine receptor 2CP08909Htr2cRattus norvegicus (Rat)460
1915535-hydroxytryptamine receptor 4O70528HTR4Cavia porcellus (Guinea pig)388
1915385-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357
1915355-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
1915745-hydroxytryptamine receptor 6P31388Htr6Rattus norvegicus (Rat)436
1916075-hydroxytryptamine receptor 6Q9R1C8Htr6Mus musculus (Mouse)440

zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417