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Ligand

NameCHEMBL474473
Molecular formulaC29H29ClN6O3
IUPAC nameN-[3-[(5-chloro-6-oxo-4-piperazin-1-ylpyridazin-1-yl)methyl]-2-methylphenyl]-4-(6-methoxypyridin-3-yl)benzamide
Molecular weight545.04
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP3.5
SynonymsSCHEMBL1161850
BDBM50412989
Inchi KeyQIRVZVCPNDJFQS-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H29ClN6O3/c1-19-23(18-36-29(38)27(30)25(17-33-36)35-14-12-31-13-15-35)4-3-5-24(19)34-28(37)21-8-6-20(7-9-21)22-10-11-26(39-2)32-16-22/h3-11,16-17,31H,12-15,18H2,1-2H3,(H,34,37)
PubChem CID25209356
ChEMBLCHEMBL474473
IUPHARN/A
BindingDB50412989
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2792965-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
2792955-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
2792975-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
279294Mas-related G-protein coupled receptor member X1Q96LB2MRGPRX1Homo sapiens (Human)322

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