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Ligand

NameCHEMBL302882
Molecular formulaC21H19Br3N4O
IUPAC name6,7-dibromo-3-[(2S,5R)-5-(6-bromo-1H-indol-3-yl)-4-methylpiperazin-2-yl]-1H-indol-4-ol
Molecular weight583.122
Hydrogen bond acceptor3
Hydrogen bond donor4
XlogP4.6
Synonyms6,7-Dibromo-3-[(2S,5R)-5-(6-bromo-1H-indol-3-yl)-4-methyl-piperazin-2-yl]-1H-indol-4-ol
114582-72-8
BDBM50287720
Dragmacidin
SCHEMBL6820934
Inchi KeyAUJKXAIGSXKZBR-SJORKVTESA-N
Inchi IDInChI=1S/C21H19Br3N4O/c1-28-9-16(13-7-27-21-19(13)18(29)5-14(23)20(21)24)26-8-17(28)12-6-25-15-4-10(22)2-3-11(12)15/h2-7,16-17,25-27,29H,8-9H2,1H3/t16-,17+/m1/s1
PubChem CID9938248
ChEMBLCHEMBL302882
IUPHARN/A
BindingDB50287720
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
14684Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
14685Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
14686Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520

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