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Ligand

Name3,8-dibromoboldine
Molecular formulaC19H19Br2NO4
IUPAC name(6aS)-3,8-dibromo-1,10-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-2,9-diol
Molecular weight485.172
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.1
SynonymsBDBM50209211
CHEMBL388564
D06FLU
Inchi KeyFTUCKVYWXINSAK-NSHDSACASA-N
Inchi IDInChI=1S/C19H19Br2NO4/c1-22-5-4-8-13-11(22)6-10-9(7-12(25-2)17(23)16(10)21)14(13)19(26-3)18(24)15(8)20/h7,11,23-24H,4-6H2,1-3H3/t11-/m0/s1
PubChem CID10480509
ChEMBLCHEMBL388564
IUPHARN/A
BindingDB50209211
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
87116Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
87113Alpha-1B adrenergic receptorP15823Adra1bRattus norvegicus (Rat)515
87114D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
87115D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444

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