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Ligand

NameCHEMBL54089
Molecular formulaC26H30N2O8
IUPAC name2-[3-[(5-methoxy-3,4-dihydro-2H-chromen-3-yl)-propylamino]propyl]isoindole-1,3-dione;oxalic acid
Molecular weight498.532
Hydrogen bond acceptor9
Hydrogen bond donor2
XlogPNone
SynonymsN/A
Inchi KeyHPGJAAUNPHKECF-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H28N2O4.C2H2O4/c1-3-12-25(17-15-20-21(29-2)10-6-11-22(20)30-16-17)13-7-14-26-23(27)18-8-4-5-9-19(18)24(26)28;3-1(4)2(5)6/h4-6,8-11,17H,3,7,12-16H2,1-2H3;(H,3,4)(H,5,6)
PubChem CID44296023
ChEMBLCHEMBL54089
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessPartition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1206645-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
1206665-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
1206655-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
120662Alpha-1A adrenergic receptorP18130ADRA1ABos taurus (Bovine)466
120667Alpha-2A adrenergic receptorQ28838ADRA2ABos taurus (Bovine)452
120661D(1A) dopamine receptorQ95136DRD1Bos taurus (Bovine)446
120663D(2) dopamine receptorP20288DRD2Bos taurus (Bovine)444

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