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

Name83184-32-1
Molecular formulaC11H9N5
IUPAC nameN-cyano-N'-[4-(1H-imidazol-5-yl)phenyl]methanimidamide
Molecular weight211.228
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP1.2
SynonymsCHEMBL127373
SCHEMBL9695925
CTK3D4175
DTXSID20603491
AEQUIERXHBACLX-UHFFFAOYSA-N
[ Show all ]
Inchi KeyAEQUIERXHBACLX-UHFFFAOYSA-N
Inchi IDInChI=1S/C11H9N5/c12-6-14-8-15-10-3-1-9(2-4-10)11-5-13-7-16-11/h1-5,7-8H,(H,13,16)(H,14,15)
PubChem CID20201840
ChEMBLCHEMBL127373
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
3767Histamine H2 receptorP47747HRH2Cavia porcellus (Guinea pig)359

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