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

NameCHEMBL1512003
Molecular formulaC19H29N5OS
IUPAC name1-[5-[bis(2-methylpropyl)amino]-1,3,4-thiadiazol-2-yl]-3-(2,5-dimethylphenyl)urea
Molecular weight375.535
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP5.1
SynonymsMolPort-007-713-501
HMS1856N22
ZINC6768107
AKOS001897548
MCULE-4156320111
[ Show all ]
Inchi KeyAGWXAEDWFFCKFA-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H29N5OS/c1-12(2)10-24(11-13(3)4)19-23-22-18(26-19)21-17(25)20-16-9-14(5)7-8-15(16)6/h7-9,12-13H,10-11H2,1-6H3,(H2,20,21,22,25)
PubChem CID16016612
ChEMBLCHEMBL1512003
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

You can:

Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5304Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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