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Ligand

NameCHEMBL71865
Molecular formulaC21H23Cl2N3O
IUPAC nameN-[(Z)-4-[4-(2,3-dichlorophenyl)piperazin-1-yl]but-2-enyl]benzamide
Molecular weight404.335
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP4.4
SynonymsBDBM50129430
N-{(Z)-4-[4-(2,3-Dichloro-phenyl)-piperazin-1-yl]-but-2-enyl}-benzamide
Inchi KeyDHOCETPWLQILEE-PLNGDYQASA-N
Inchi IDInChI=1S/C21H23Cl2N3O/c22-18-9-6-10-19(20(18)23)26-15-13-25(14-16-26)12-5-4-11-24-21(27)17-7-2-1-3-8-17/h1-10H,11-16H2,(H,24,27)/b5-4-
PubChem CID9887463
ChEMBLCHEMBL71865
IUPHARN/A
BindingDB50129430
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
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GLASS IDNameUniProtGeneSpeciesLength
60178D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
60180D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
60177D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400
60179D(3) dopamine receptorP19020Drd3Rattus norvegicus (Rat)446

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