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Ligand

NameSCHEMBL6118235
Molecular formulaC21H16ClN3O3
IUPAC name6-[(6-chloro-5-methoxy-2-pyridin-3-ylindol-1-yl)methyl]pyridine-2-carboxylic acid
Molecular weight393.827
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.6
SynonymsUS8680120, 25-42
CHEMBL3665576
BDBM119482
Inchi KeyMZBDRQVEULUYPF-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H16ClN3O3/c1-28-20-9-14-8-18(13-4-3-7-23-11-13)25(19(14)10-16(20)22)12-15-5-2-6-17(24-15)21(26)27/h2-11H,12H2,1H3,(H,26,27)
PubChem CID50907869
ChEMBLCHEMBL3665576
IUPHARN/A
BindingDB119482
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
217691Prostaglandin E2 receptor EP1 subtypeP70597Ptger1Rattus norvegicus (Rat)405

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