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 DMFold 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

NameN6-Cyclopentyladenosine
Molecular formulaC15H21N5O4
IUPAC name(2R,3R,4S,5R)-2-[6-(cyclopentylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Molecular weight335.364
Hydrogen bond acceptor8
Hydrogen bond donor4
XlogP0.9
SynonymsMolPort-023-276-193
N6-CyclopentylAdo
SMR000058639
41552-82-3
BDBM25400
[ Show all ]
Inchi KeySQMWSBKSHWARHU-SDBHATRESA-N
Inchi IDInChI=1S/C15H21N5O4/c21-5-9-11(22)12(23)15(24-9)20-7-18-10-13(16-6-17-14(10)20)19-8-3-1-2-4-8/h6-9,11-12,15,21-23H,1-5H2,(H,16,17,19)/t9-,11-,12-,15-/m1/s1
PubChem CID657378
ChEMBLCHEMBL68738
IUPHAR380
BindingDB25400
DrugBankN/A

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 16
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
320764Adenosine receptor A1P25099Adora1Rattus norvegicus (Rat)326
320766Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
320767Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326
320771Adenosine receptor A1P28190ADORA1Bos taurus (Bovine)326
320778Adenosine receptor A1P49892ADORA1Gallus gallus (Chicken)324
320779Adenosine receptor A1P34970ADORA1Oryctolagus cuniculus (Rabbit)328
320765Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
320770Adenosine receptor A2aP30543Adora2aRattus norvegicus (Rat)410
320773Adenosine receptor A2bP29275ADORA2BHomo sapiens (Human)332
320768Adenosine receptor A3P28647Adora3Rattus norvegicus (Rat)320
320769Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318
320775Adenosine receptor A3O02667ADORA3Oryctolagus cuniculus (Rabbit)319
320774Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
320777Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
320772Relaxin receptor 2Q8WXD0RXFP2Homo sapiens (Human)754
320776Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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