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Ligand

NameCHEMBL3781035
Molecular formulaC25H33NO4
IUPAC name10-hexoxy-3,9-dimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-2-ol
Molecular weight411.542
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.2
SynonymsBDBM50152843
Inchi KeyACIKAIVCJBOQAN-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H33NO4/c1-4-5-6-7-12-30-23-9-8-17-13-21-19-15-22(27)24(28-2)14-18(19)10-11-26(21)16-20(17)25(23)29-3/h8-9,14-15,21,27H,4-7,10-13,16H2,1-3H3
PubChem CID127031398
ChEMBLCHEMBL3781035
IUPHARN/A
BindingDB50152843
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
521489D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
521490D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
521488D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400

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