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Ligand

NameCHEMBL372222
Molecular formulaC25H26ClN5O2
IUPAC name3-[2-[4-(2-chlorophenyl)piperazin-1-yl]ethyl]-6-(4-methylphenyl)-1,5-dihydropyrrolo[3,2-d]pyrimidine-2,4-dione
Molecular weight463.966
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.0
SynonymsBDBM50164343
3-(2-(4-(2-chlorophenyl)piperazin-1-yl)ethyl)-6-p-tolyl-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione
3-{2-[4-(2-Chloro-phenyl)-piperazin-1-yl]-ethyl}-6-p-tolyl-1,5-dihydro-pyrrolo[3,2-d]pyrimidine-2,4-dione
Inchi KeyDSHAQKQNBSNNEJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H26ClN5O2/c1-17-6-8-18(9-7-17)20-16-21-23(27-20)24(32)31(25(33)28-21)15-12-29-10-13-30(14-11-29)22-5-3-2-4-19(22)26/h2-9,16,27H,10-15H2,1H3,(H,28,33)
PubChem CID11751611
ChEMBLCHEMBL372222
IUPHARN/A
BindingDB50164343
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
675805-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
675865-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
67587Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
67584Alpha-1B adrenergic receptorP15823Adra1bRattus norvegicus (Rat)515
67582Alpha-1D adrenergic receptorP23944Adra1dRattus norvegicus (Rat)561
67579D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
67581D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
67583D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
67585D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443

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