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

NameTAN-67
Molecular formulaC23H24N2O
IUPAC name3-[(4aS,12aR)-2-methyl-1,3,4,5,12,12a-hexahydropyrido[3,4-b]acridin-4a-yl]phenol
Molecular weight344.458
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP4.3
Synonyms(-)-rel-3-((4aR,12aS)-2-methyl-1,2,3,4,4a,5,12,12a-octahydropyrido[3,4-b]acridin-4a-yl)phenol
C20168
3-((4aS,12aR)-2-Methyl-1,3,4,5,12,12a-hexahydro-2H-2,6-diaza-naphthacen-4a-yl)-phenol
CHEMBL327745
SB-213698
[ Show all ]
Inchi KeyLEPBHAAYNPPRRA-WMZHIEFXSA-N
Inchi IDInChI=1S/C23H24N2O/c1-25-10-9-23(18-6-4-7-20(26)13-18)14-22-17(12-19(23)15-25)11-16-5-2-3-8-21(16)24-22/h2-8,11,13,19,26H,9-10,12,14-15H2,1H3/t19-,23+/m0/s1
PubChem CID9950038
ChEMBLCHEMBL327745
IUPHAR9567
BindingDB50290872
DrugBankN/A

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 8
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
185471Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
185473Delta-type opioid receptorP32300Oprd1Mus musculus (Mouse)372
185474Delta-type opioid receptorP33533Oprd1Rattus norvegicus (Rat)372
185470Kappa-type opioid receptorP33534Oprk1Mus musculus (Mouse)380
185475Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
526812Mas-related G-protein coupled receptor member X2Q96LB1MRGPRX2Homo sapiens (Human)330
185472Mu-type opioid receptorP33535Oprm1Rattus norvegicus (Rat)398
185476Mu-type opioid receptorP42866Oprm1Mus musculus (Mouse)398

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