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Ligand

NameCHEMBL452353
Molecular formulaC32H36ClN5O6
IUPAC name2-[4-[5-(6-amino-1,3-dioxobenzo[de]isoquinolin-2-yl)pentanoylamino]piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate
Molecular weight622.119
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogP3.5
SynonymsN/A
Inchi KeyCJQFLHKXINHNKQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C32H36ClN5O6/c1-43-27-18-26(35)24(33)17-23(27)32(42)44-16-15-37-13-10-19(11-14-37)36-28(39)7-2-3-12-38-30(40)21-6-4-5-20-25(34)9-8-22(29(20)21)31(38)41/h4-6,8-9,17-19H,2-3,7,10-16,34-35H2,1H3,(H,36,39)
PubChem CID44582815
ChEMBLCHEMBL452353
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
436165-hydroxytryptamine receptor 4Q13639HTR4Homo sapiens (Human)388

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