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Ligand

NameCHEMBL99987
Molecular formulaC22H24N2O2
IUPAC nameN-[2-(4-methoxy-1-phenylindol-2-yl)ethyl]cyclobutanecarboxamide
Molecular weight348.446
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP4.2
SynonymsN-[2-(1-Phenyl-4-methoxy-1H-indole-2-yl)ethyl]cyclobutanecarboxamide
Inchi KeyBWEXMUGOWBSZPR-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H24N2O2/c1-26-21-12-6-11-20-19(21)15-18(24(20)17-9-3-2-4-10-17)13-14-23-22(25)16-7-5-8-16/h2-4,6,9-12,15-16H,5,7-8,13-14H2,1H3,(H,23,25)
PubChem CID10893437
ChEMBLCHEMBL99987
IUPHARN/A
BindingDBN/A
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
34378Melatonin receptor type 1AP48039MTNR1AHomo sapiens (Human)350
34377Melatonin receptor type 1BP49286MTNR1BHomo sapiens (Human)362

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