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

NameMLS001095734
Molecular formulaC20H20N2O4S
IUPAC name5-(2-cyclopropyl-1,3-oxazol-5-yl)-N-(4-methoxyphenyl)-2-methylbenzenesulfonamide
Molecular weight384.45
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.4
SynonymsCCG-186505
SMR000631543
HMS2953O23
AB00834933-06
MolPort-007-855-621
[ Show all ]
Inchi KeyAASLFJRQVQWRMA-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H20N2O4S/c1-13-3-4-15(18-12-21-20(26-18)14-5-6-14)11-19(13)27(23,24)22-16-7-9-17(25-2)10-8-16/h3-4,7-12,14,22H,5-6H2,1-2H3
PubChem CID20959120
ChEMBLCHEMBL1536342
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
492Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
493Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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