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

NameCHEMBL2381672
Molecular formulaC22H28N4O3
IUPAC nameN-cyclohexyl-2-(furan-2-yl)-7-oxo-4-pentylpyrazolo[1,5-a]pyrimidine-6-carboxamide
Molecular weight396.491
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.3
SynonymsN/A
Inchi KeyBSCFQWLVUOTQPC-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H28N4O3/c1-2-3-7-12-25-15-17(21(27)23-16-9-5-4-6-10-16)22(28)26-20(25)14-18(24-26)19-11-8-13-29-19/h8,11,13-16H,2-7,9-10,12H2,1H3,(H,23,27)
PubChem CID71681348
ChEMBLCHEMBL2381672
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
31525Cannabinoid receptor 1P20272Cnr1Rattus norvegicus (Rat)473
31527Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
31524Cannabinoid receptor 2Q9QZN9Cnr2Rattus norvegicus (Rat)360
31526Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360

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