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Ligand

NameA-123189
Molecular formulaC26H28N4O3S
IUPAC name3-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-5-(3-methylphenyl)-1H-thieno[2,3-d]pyrimidine-2,4-dione
Molecular weight476.595
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.2
SynonymsD0EO4F
3-[2-[4-(2-Methoxyphenyl)piperazino]ethyl]-5-m-tolyl-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-2,4-dione
GTPL491
A123189
3-{2-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-ethyl}-5-m-tolyl-1H-thieno[2,3-d]pyrimidine-2,4-dione
[ Show all ]
Inchi KeyPANBMHHKBRMYAL-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H28N4O3S/c1-18-6-5-7-19(16-18)20-17-34-24-23(20)25(31)30(26(32)27-24)15-12-28-10-13-29(14-11-28)21-8-3-4-9-22(21)33-2/h3-9,16-17H,10-15H2,1-2H3,(H,27,32)
PubChem CID9891167
ChEMBLCHEMBL13856
IUPHAR491
BindingDB50099325
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: 12
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
254920Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
254921Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
254925Alpha-1A adrenergic receptorP18130ADRA1ABos taurus (Bovine)466
254919Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
254923Alpha-1B adrenergic receptorP15823Adra1bRattus norvegicus (Rat)515
254917Alpha-1D adrenergic receptorP25100ADRA1DHomo sapiens (Human)572
254922Alpha-1D adrenergic receptorP23944Adra1dRattus norvegicus (Rat)561
254927Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
254924Alpha-2B adrenergic receptorP19328Adra2bRattus norvegicus (Rat)453
254918Alpha-2C adrenergic receptorP18825ADRA2CHomo sapiens (Human)462
254916D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
254926D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444

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