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Ligand

NameCHEMBL303334
Molecular formulaC15H20Br2N2O3
IUPAC name3,5-dibromo-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxybenzamide
Molecular weight436.144
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP3.0
SynonymsAC1MHWAJ
FLA-659
BDBM50026053
PDSP2_000911
A 36569
[ Show all ]
Inchi KeyJNFBCMWINGLNPB-VIFPVBQESA-N
Inchi IDInChI=1S/C15H20Br2N2O3/c1-3-19-6-4-5-9(19)8-18-15(21)12-13(20)10(16)7-11(17)14(12)22-2/h7,9,20H,3-6,8H2,1-2H3,(H,18,21)/t9-/m0/s1
PubChem CID3033771
ChEMBLN/A
IUPHARN/A
BindingDB50026053
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: 9
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5560585-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
5560605-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
155059Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
155060Alpha-2C adrenergic receptorP22086Adra2cRattus norvegicus (Rat)458
460619Beta-2 adrenergic receptorP10608Adrb2Rattus norvegicus (Rat)418
155057D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
556059D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
155056Histamine H1 receptorP31390Hrh1Rattus norvegicus (Rat)486
155058Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466

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