Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only
Online Services

I-TASSER C-I-TASSER QUARK C-QUARK LOMETS COACH COFACTOR MetaGO MUSTER CEthreader SEGMER FG-MD ModRefiner REMO DEMO SPRING COTH Threapp BSpred ANGLOR EDock BSP-SLIM SAXSTER FUpred ThreaDom ThreaDomEx EvoDesign GPCR-I-TASSER MAGELLAN BindProf BindProfX SSIPe ResQ IonCom STRUM DAMpred

TM-score TM-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 WDL-RF ATPbind DockRMSD DeepMSA FASPR EM-Refiner

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

NameMLS000705653
Molecular formulaC17H26N2O4S
IUPAC nameN-[4-(hexylsulfamoyl)phenyl]oxolane-2-carboxamide
Molecular weight354.465
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.8
SynonymsN-[4-(hexylsulfamoyl)phenyl]oxolane-2-carboxamide
AC1NO5O7
HMS2549D08
N-{4-[(hexylamino)sulfonyl]phenyl}tetrahydro-2-furancarboxamide
ST50624692
[ Show all ]
Inchi KeyAPXMICVTOJLGHL-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H26N2O4S/c1-2-3-4-5-12-18-24(21,22)15-10-8-14(9-11-15)19-17(20)16-7-6-13-23-16/h8-11,16,18H,2-7,12-13H2,1H3,(H,19,20)
PubChem CID5132730
ChEMBLCHEMBL1353075
IUPHARN/A
BindingDB42572
DrugBankN/A

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
11432Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
11431Neuropeptide Y receptor type 1P25929NPY1RHomo sapiens (Human)384
11433Neuropeptide Y receptor type 2P49146NPY2RHomo sapiens (Human)381

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