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

I-TASSER QUARK LOMETS COACH COFACTOR MetaGO MUSTER CEthreader SEGMER FG-MD ModRefiner REMO DEMO SPRING COTH 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 WDL-RF ATPbind DockRMSD DeepMSA FASPR

BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

You can:

Ligand

NameU-69593
Molecular formulaC22H32N2O2
IUPAC nameN-methyl-2-phenyl-N-[(5R,7S,8S)-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-8-yl]acetamide
Molecular weight356.51
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP3.0
SynonymsU69593
96744-75-1
U 69593
UNII-J5S4K6TKTG
U 69,593
[ Show all ]
Inchi KeyPGZRDDYTKFZSFR-ONTIZHBOSA-N
Inchi IDInChI=1S/C22H32N2O2/c1-23(21(25)16-18-8-3-2-4-9-18)19-10-12-22(11-7-15-26-22)17-20(19)24-13-5-6-14-24/h2-4,8-9,19-20H,5-7,10-17H2,1H3/t19-,20-,22-/m0/s1
PubChem CID105104
ChEMBLCHEMBL440765
IUPHAR1655, 1656
BindingDB21130
DrugBankN/A

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 14
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
259533Delta-type opioid receptorP33533Oprd1Rattus norvegicus (Rat)372
259534Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
461469Delta-type opioid receptorP79291OPRD1Sus scrofa (Pig)228
495074Delta-type opioid receptorP32300Oprd1Mus musculus (Mouse)372
259529Kappa-type opioid receptorP34975Oprk1Rattus norvegicus (Rat)380
259530Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
259531Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
554562Kappa-type opioid receptorP33534Oprk1Mus musculus (Mouse)380
259528Mu-type opioid receptorP97266OPRM1Cavia porcellus (Guinea pig)98
259532Mu-type opioid receptorP33535Oprm1Rattus norvegicus (Rat)398
495073Mu-type opioid receptorP42866Oprm1Mus musculus (Mouse)398
495075Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
495076Nociceptin receptorP41146OPRL1Homo sapiens (Human)370
495077Nociceptin receptorP47748OPRL1Cavia porcellus (Guinea pig)370

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