Zhang Lab

University of Michigan

Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only

Online Services

●I-TASSER ●I-TASSER-MTD ●C-I-TASSER ●CR-I-TASSER ●QUARK ●C-QUARK ●LOMETS ●MUSTER ●CEthreader ●SEGMER ●DeepFold ●DeepFoldRNA ●FoldDesign ●COFACTOR ●COACH ●MetaGO ●TripletGO ●IonCom ●FG-MD ●ModRefiner ●REMO ●DEMO ●DEMO-EM ●DMFold ●SPRING ●COTH ●Threpp ●PEPPI ●BSpred ●ANGLOR ●EDock ●BSP-SLIM ●SAXSTER ●FUpred ●ThreaDom ●ThreaDomEx ●EvoDesign ●BindProf ●BindProfX ●SSIPe ●GPCR-I-TASSER ●MAGELLAN ●ResQ ●STRUM ●DAMpred

●TM-score ●TM-align ●US-align ●MM-align ●RNA-align ●NW-align ●LS-align ●EDTSurf ●MVP ●MVP-Fit ●SPICKER ●HAAD ●PSSpred ●3DRobot ●MR-REX ●I-TASSER-MR ●SVMSEQ ●NeBcon ●ResPRE ●TripletRes ●DeepPotential ●WDL-RF ●ATPbind ●DockRMSD ●DeepMSA ●FASPR ●EM-Refiner ●GPU-I-TASSER

●BioLiP ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●ADDRESS ●Alpaca-Antibody ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13 ●CASP14

GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	1-(3-nitropyridin-2-yl)piperazine
Molecular formula	C9H12N4O2
IUPAC name	1-(3-nitropyridin-2-yl)piperazine
Molecular weight	208.221
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	0.5
Synonyms	Z-8288 1-(3-nitro-pyridin-2-yl)piperazine 87394-48-7 AN-35463 DTXSID50396304 N67400 1-(3--Nitro-2-pyridinyl)piperazine 1220AF AC1Q1Y3W BDBM50027020 HSAKGWZDXDRYTB-UHFFFAOYSA-N RP26416 STK360702 1-(3-nitro-2-pyridyl)piperazine 394N487 AKOS015940997 CN-480 KB-105694 Z2255110741 AB0153967 AS-9019 FT-0678152 piperazine, 1-(3-nitro-2-pyridinyl)-, dihydrochloride SBB055736 1-(3-Nitorpyridin-2-yl)piperazine 2-(1-Piperazinyl)-3-nitropyridine AJ-74719 I13-391 TR-027342 1-(3-Nitro-pyridin-2-yl)-piperazine ALBB-013082 CTK5F8315 MolPort-000-005-125 ZINC6658183 (3-nitro-2-pyridyl)piperazine 1-(3-nitropyridin-2-yl)piperazine dihydrochloride AC1MWRKB BBL022252 H8388 Piperazine,1-(3-nitro-2-pyridinyl)- SCHEMBL2898307 1-(3-nitro-2-pyridinyl)piperazine 2-Piperazino-3-nitropyridine AKOS000123163 CHEMBL296653 J-503171 [ Show all ]
Inchi Key	HSAKGWZDXDRYTB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C9H12N4O2/c14-13(15)8-2-1-3-11-9(8)12-6-4-10-5-7-12/h1-3,10H,4-7H2
PubChem CID	3778834
ChEMBL	CHEMBL296653
IUPHAR	N/A
BindingDB	50027020
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
122583	Alpha-1A adrenergic receptor	P18130	ADRA1A	Bos taurus (Bovine)	466
122582	Alpha-2A adrenergic receptor	Q28838	ADRA2A	Bos taurus (Bovine)	452

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