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Ligand

NameSCHEMBL3498213
Molecular formulaC31H25ClN4O4
IUPAC name2-[[6-[(E)-2-(4-chlorophenyl)ethenyl]imidazo[1,2-b]pyridazine-2-carbonyl]amino]-3-(4-phenylmethoxyphenyl)propanoic acid
Molecular weight553.015
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP5.9
SynonymsCHEMBL3717294
SCHEMBL3499210
Inchi KeyCRFNZFBQPIZHDY-MDWZMJQESA-N
Inchi IDInChI=1S/C31H25ClN4O4/c32-24-11-6-21(7-12-24)8-13-25-14-17-29-33-28(19-36(29)35-25)30(37)34-27(31(38)39)18-22-9-15-26(16-10-22)40-20-23-4-2-1-3-5-23/h1-17,19,27H,18,20H2,(H,34,37)(H,38,39)/b13-8+
PubChem CID11526871
ChEMBLCHEMBL3717294
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
522960Probable G-protein coupled receptor 34Q9UPC5GPR34Homo sapiens (Human)381

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