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

NameCHEMBL228849
Molecular formulaC24H24ClNO
IUPAC name1-[(2-chlorophenyl)-phenylmethyl]-4-phenylpiperidin-4-ol
Molecular weight377.912
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP5.2
Synonyms1-((2-chlorophenyl)(phenyl)methyl)-4-phenylpiperidin-4-ol
BDBM50210404
Inchi KeyAYGQBTFSCJJCQP-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H24ClNO/c25-22-14-8-7-13-21(22)23(19-9-3-1-4-10-19)26-17-15-24(27,16-18-26)20-11-5-2-6-12-20/h1-14,23,27H,15-18H2
PubChem CID9951673
ChEMBLCHEMBL228849
IUPHARN/A
BindingDB50210404
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

You can:

Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
17455Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
17452Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
17454Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
17453Nociceptin receptorP41146OPRL1Homo sapiens (Human)370

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