Home Research Services Publications People Teaching Job Opening Facilities News Forum Lab Only
Online Services

I-TASSER QUARK LOMETS COACH COFACTOR MetaGO MUSTER SEGMER FG-MD ModRefiner REMO DEMO SPRING COTH BSpred SVMSEQ ANGLOR BSP-SLIM SAXSTER ThreaDom ThreaDomEx EvoDesign GPCR-I-TASSER BindProf BindProfX ResQ IonCom STRUM DAMpred

TM-score TM-align MM-align RNA-align NW-align LS-align EDTSurf MVP MVP-Fit SPICKER HAAD PSSpred 3DRobot MR-REX I-TASSER-MR NeBcon WDL-RF ATPbind DockRMSD

BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP TM-fold DECOYS POTENTIAL RW/RWplus HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

You can:

Ligand

NameCHEMBL534719
Molecular formulaC27H30ClN3O
IUPAC nameN-[(1R,2R)-2-(1-naphthalen-1-ylethylamino)cyclohexyl]-1H-indole-2-carboxamide;hydrochloride
Molecular weight448.007
Hydrogen bond acceptor2
Hydrogen bond donor4
XlogPNone
SynonymsN/A
Inchi KeyAGIJLMDKPFJDEN-TVWFESHXSA-N
Inchi IDInChI=1S/C27H29N3O.ClH/c1-18(21-13-8-11-19-9-2-4-12-22(19)21)28-24-15-6-7-16-25(24)30-27(31)26-17-20-10-3-5-14-23(20)29-26;/h2-5,8-14,17-18,24-25,28-29H,6-7,15-16H2,1H3,(H,30,31);1H/t18?,24-,25-;/m1./s1
PubChem CID11849430
ChEMBLCHEMBL534719
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
4903Extracellular calcium-sensing receptorP48442CasrRattus norvegicus (Rat)1079

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