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

NameCHEMBL364005
Molecular formulaC14H15ClN2
IUPAC name5-chloro-2-methyl-3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indole
Molecular weight246.738
Hydrogen bond acceptor1
Hydrogen bond donor2
XlogP2.8
Synonyms54635-62-0
GTPL8428
5-chloranyl-2-methyl-3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indole
AKOS023409828
DTXSID30436055
[ Show all ]
Inchi KeyBPPGPYJBCVXILI-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H15ClN2/c1-9-14(10-4-6-16-7-5-10)12-8-11(15)2-3-13(12)17-9/h2-4,8,16-17H,5-7H2,1H3
PubChem CID10131112
ChEMBLCHEMBL364005
IUPHAR8428
BindingDB50171235
DrugBankN/A

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 8
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
297615-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
297655-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
297675-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
297645-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
297665-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
297635-hydroxytryptamine receptor 4O70528HTR4Cavia porcellus (Guinea pig)388
297605-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
297625-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479

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