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	51639-48-6
Molecular formula	C12H16N2O
IUPAC name	1-(4-piperazin-1-ylphenyl)ethanone
Molecular weight	204.273
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	0.9
Synonyms	C-10008 Ethanone, 1-[4-(1-piperazinyl)phenyl]- KPXVKKBJROCIJB-UHFFFAOYSA-N OR0219 SR-01000059922 1-(4-acetylphenyl) piperazine VP70144 1-acetyl-4-piperazinylbenzene 4'-Piperazinoacetophenone 7213AB AJ-08480 AX8014119 CHEMBL166330 FT-0617368 MFCD00005962 Piperazin-4-ylacetophenone ST24037298 1-(4-Piperazin-1-yl-phenyl)-ethanone ZX-AT004644 1-[4-(piperazin-1-yl)phenyl]ethan-1-one 4-piperazino acetophenone AC1Q1JPC BDBM50001899 DTXSID00199584 KB-147069 NSC-109890 SC-62400 1-(4-(piperazin-1-yl)phenyl)ethanone TR-018393 1-(4-piperazine-1-yl-phenyl)-ethanone 4'-(Piperazin-1-yl)acetophenone ACM51639486 CC-02154 Ethanone,1-[4-(1-piperazinyl)phenyl]- KS-00002BJA p-Piperazinoacetophenone SR-01000059922-1 1-(4-acetylphenyl)-piperazine X-4409 1-[4-(1-Piperazinyl)phenyl]-1-ethanone 4'-Piperazinoacetophenone, 94% AB0118188 AK122324 BBL016329 CTK4J4599 I13-0287 MolPort-000-006-194 PubChem13361 STK400476 1-(4-Piperazin-1-yl-phenyl)ethanone 1-[4-(piperazin-1-yl)phenyl]ethanone 4-piperazinoacetophenone AC1Q1JPD BIDD:GT0584 EINECS 257-332-6 KB-147467 NSC109890 SCHEMBL232986 1-(4-Acetyl-phenyl)piperazine TS-02904 1-(p-acetylphenyl)piperazine 4'-piperazino-acetophenone ACMC-1AM8S F2190-0511 MCULE-2994216639 P67186 ST042067 1-(4-acetylphenyl)piperazine ZINC29076 1-[4-(1-Piperazinyl)phenyl]ethanone # 4-(4-acetylphenyl)piperazine AC1L3Y5U AKOS000120540 BB_SC-01973 DB-018540 InChI=1/C12H16N2O/c1-10(15)11-2-4-12(5-3-11)14-8-6-13-7-9-14/h2-5,13H,6-9H2,1H n-(4-acetylphenyl)piperazine SBB055067 1-(4-(piperazin-1-yl)phenyl)ethan-1-one STR06370 1-(4-piperazin-1-ylphenyl)ethanone 4'-(1-Piperazino)acetophenone C12H16N2O 204.27 93-98 degrees 51639-48-6 257-332-6 MFCD00005962 UN3259 8 N 4-Piperazinoacetophenone, 94% AC1Q5DY9 [ Show all ]
Inchi Key	KPXVKKBJROCIJB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C12H16N2O/c1-10(15)11-2-4-12(5-3-11)14-8-6-13-7-9-14/h2-5,13H,6-9H2,1H3
PubChem CID	97269
ChEMBL	CHEMBL166330
IUPHAR	N/A
BindingDB	50001899
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
175236	Beta-1 adrenergic receptor	P08588	ADRB1	Homo sapiens (Human)	477
175235	Beta-2 adrenergic receptor	P54833	ADRB2	Canis lupus familiaris (Dog)	415

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