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Ligand

NameCHEMBL1771111
Molecular formulaC29H35N3O2S
IUPAC name2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-7-thiophen-2-yl-4,5-dihydro-3H-2-benzazepin-1-one
Molecular weight489.678
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP5.4
SynonymsBDBM50342705
2-[4-(4-(2-Methoxyphenyl)piperazin-1-yl)butyl]-2,3,4,5-tetrahydro-7-(2-thienyl)benzo[c]azepin-1-one
Inchi KeyOXVZLPIGSCONSD-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H35N3O2S/c1-34-27-10-3-2-9-26(27)31-19-17-30(18-20-31)14-4-5-15-32-16-6-8-23-22-24(28-11-7-21-35-28)12-13-25(23)29(32)33/h2-3,7,9-13,21-22H,4-6,8,14-20H2,1H3
PubChem CID54581964
ChEMBLCHEMBL1771111
IUPHARN/A
BindingDB50342705
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2528835-hydroxytryptamine receptor 2AP50129HTR2ASus scrofa (Pig)470
252884D(1A) dopamine receptorP50130DRD1Sus scrofa (Pig)446
252882D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
252885D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400
528761D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467

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