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

NameN,N'-diallyl-1,4-cyclohexanedicarboxamide
Molecular formulaC14H22N2O2
IUPAC name1-N,4-N-bis(prop-2-enyl)cyclohexane-1,4-dicarboxamide
Molecular weight250.342
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP1.3
SynonymsAC1M3B1O
N~1~,N~4~-diallyl-1,4-cyclohexanedicarboxamide
MLS000665306
ARONIS009509
CHEMBL1528717
[ Show all ]
Inchi KeyAEJQXXKRRSAFAC-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H22N2O2/c1-3-9-15-13(17)11-5-7-12(8-6-11)14(18)16-10-4-2/h3-4,11-12H,1-2,5-10H2,(H,15,17)(H,16,18)
PubChem CID2234553
ChEMBLCHEMBL1528717
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463317Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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