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Ligand

NameCHEMBL401690
Molecular formulaC20H22INO4
IUPAC name(6aS)-3-iodo-1,9,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol
Molecular weight467.303
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.7
Synonyms(S)-3-iodo-1,9,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol
BDBM50202311
Inchi KeyBJVUGLIHJZKICR-ZDUSSCGKSA-N
Inchi IDInChI=1S/C20H22INO4/c1-22-6-5-11-16-13(22)7-10-8-14(24-2)15(25-3)9-12(10)17(16)20(26-4)19(23)18(11)21/h8-9,13,23H,5-7H2,1-4H3/t13-/m0/s1
PubChem CID11619691
ChEMBLCHEMBL401690
IUPHARN/A
BindingDB50202311
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
25499D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
25500D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444

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