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

NameMLS000061371
Molecular formulaC9H7ClN2O2S
IUPAC name5-(5-chloro-2-methoxyphenyl)-3H-1,3,4-oxadiazole-2-thione
Molecular weight242.677
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.6
Synonyms5-(5-chloro-2-methoxyphenyl)-3H-1,3,4-oxadiazole-2-thione
CB13831
EU-0012735
ST4050018
5-(5-chloranyl-2-methoxy-phenyl)-3H-1,3,4-oxadiazole-2-thione
[ Show all ]
Inchi KeyFOBNNSSNVSMNMG-UHFFFAOYSA-N
Inchi IDInChI=1S/C9H7ClN2O2S/c1-13-7-3-2-5(10)4-6(7)8-11-12-9(15)14-8/h2-4H,1H3,(H,12,15)
PubChem CID701063
ChEMBLCHEMBL1374054
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
83113Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
83116Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
83115Relaxin receptor 2Q8WXD0RXFP2Homo sapiens (Human)754
83114Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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