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

NameMLS000058692
Molecular formulaC13H7ClN6S2
IUPAC name4-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylthieno[2,3-d]pyrimidine
Molecular weight346.811
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP4.2
Synonyms4-[[1-(4-chlorophenyl)-5-tetrazolyl]thio]thieno[2,3-d]pyrimidine
cid_2112599
ZINC2649462
AC1M28ET
4-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylthieno[2,3-d]pyrimidine
[ Show all ]
Inchi KeyFEXPLGPKTJVGOT-UHFFFAOYSA-N
Inchi IDInChI=1S/C13H7ClN6S2/c14-8-1-3-9(4-2-8)20-13(17-18-19-20)22-12-10-5-6-21-11(10)15-7-16-12/h1-7H
PubChem CID2112599
ChEMBLCHEMBL1557820
IUPHARN/A
BindingDB31061
DrugBankN/A

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
767375-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
767335-hydroxytryptamine receptor 1EP28566HTR1EHomo sapiens (Human)365
76735Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
76736Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
76734Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382
76732Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378

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