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Ligand

NameCHEMBL2113718
Molecular formulaC16H18N4
IUPAC name4-[(4-phenylpiperazin-1-yl)methyl]-1H-pyrrole-2-carbonitrile
Molecular weight266.348
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.2
SynonymsBDBM50403915
4-(4-Phenylpiperazinomethyl)-1H-pyrrole-2-carbonitrile
Inchi KeyAPOXKSCRLNZDPC-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H18N4/c17-11-15-10-14(12-18-15)13-19-6-8-20(9-7-19)16-4-2-1-3-5-16/h1-5,10,12,18H,6-9,13H2
PubChem CID71458071
ChEMBLCHEMBL2113718
IUPHARN/A
BindingDB50403915
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
111965-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
111915-hydroxytryptamine receptor 2AP50129HTR2ASus scrofa (Pig)470
11195D(1A) dopamine receptorQ95136DRD1Bos taurus (Bovine)446
11192D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
11193D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400
11194D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467

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