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

Nametrihexyphenidyl
Molecular formulaC20H31NO
IUPAC name1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol
Molecular weight301.474
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP4.5
Synonyms5-20-02-00231 (Beilstein Handbook Reference)
Spectrum3_001375
Apo-Trihex
Trihexifenidilo [INN-Spanish]
Benzhexolum
[ Show all ]
Inchi KeyHWHLPVGTWGOCJO-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H31NO/c22-20(18-10-4-1-5-11-18,19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21/h1,4-5,10-11,19,22H,2-3,6-9,12-17H2
PubChem CID5572
ChEMBLCHEMBL1490
IUPHARN/A
BindingDB81462
DrugBankDB00376

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 10
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
555976Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
125562Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460
125563Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
125557Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466
125558Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466
125560Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590
125564Muscarinic acetylcholine receptor M3P08483Chrm3Rattus norvegicus (Rat)589
125561Muscarinic acetylcholine receptor M4P08173CHRM4Homo sapiens (Human)479
125565Muscarinic acetylcholine receptor M4P17200CHRM4Gallus gallus (Chicken)490
125559Muscarinic acetylcholine receptor M5P08912CHRM5Homo sapiens (Human)532

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