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

NameCHEMBL556364
Molecular formulaC24H28ClN3O
IUPAC nameN-[(1R,2R)-2-(1-naphthalen-1-ylethylamino)cyclohexyl]pyridine-2-carboxamide;hydrochloride
Molecular weight409.958
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogPNone
SynonymsN/A
Inchi KeyMDKLEAYQTJPHPX-QLJIVMRRSA-N
Inchi IDInChI=1S/C24H27N3O.ClH/c1-17(19-12-8-10-18-9-2-3-11-20(18)19)26-21-13-4-5-14-22(21)27-24(28)23-15-6-7-16-25-23;/h2-3,6-12,15-17,21-22,26H,4-5,13-14H2,1H3,(H,27,28);1H/t17?,21-,22-;/m1./s1
PubChem CID11849389
ChEMBLCHEMBL556364
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessPartition coefficient log P of this ligand is not available.

Known GPCRs

You can:

Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
202756Extracellular calcium-sensing receptorP48442CasrRattus norvegicus (Rat)1079

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