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Ligand

Namech56
Molecular formulaC19H19N5
IUPAC name2-[[4-[(4-phenylpiperazin-1-yl)methyl]-1H-pyrrol-2-yl]methylidene]propanedinitrile
Molecular weight317.396
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.2
SynonymsCHEMBL294459
BDBM50079644
ZINC84462640
KB-271950
2-[4-(4-Phenylpiperazinomethyl)-1H-pyrrole-2-ylmethylene]malononitrile
[ Show all ]
Inchi KeyFASYQPOSAUOTDU-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H19N5/c20-12-16(13-21)10-18-11-17(14-22-18)15-23-6-8-24(9-7-23)19-4-2-1-3-5-19/h1-5,10-11,14,22H,6-9,15H2
PubChem CID10425969
ChEMBLCHEMBL294459
IUPHARN/A
BindingDB50079644
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
73773D(1A) dopamine receptorQ95136DRD1Bos taurus (Bovine)446
73772D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
73774D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400
73775D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467

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