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

NameSMR000235764
Molecular formulaC22H26N4O3S2
IUPAC name4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N'-(4-methyl-1,3-benzothiazol-2-yl)benzohydrazide
Molecular weight458.595
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP5.1
Synonyms4-((3,5-dimethylpiperidin-1-yl)sulfonyl)-N'-(4-methylbenzo[d]thiazol-2-yl)benzohydrazide
4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N''-(4-methyl-1,3-benzothiazol-2-yl)benzohydrazide
4-(3,5-dimethylpiperidino)sulfonyl-N''-(4-methyl-1,3-benzothiazol-2-yl)benzohydrazide
4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-N''-(4-methyl-1,3-benzothiazol-2-yl)benzohydrazide
851978-00-2
[ Show all ]
Inchi KeyLBTRDZPKEWBWFH-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H26N4O3S2/c1-14-11-15(2)13-26(12-14)31(28,29)18-9-7-17(8-10-18)21(27)24-25-22-23-20-16(3)5-4-6-19(20)30-22/h4-10,14-15H,11-13H2,1-3H3,(H,23,25)(H,24,27)
PubChem CID12006167
ChEMBLCHEMBL1335491
IUPHARN/A
BindingDB41953
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
183567Galanin receptor type 2O43603GALR2Homo sapiens (Human)387

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