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Ligand

NameCHEMBL2326200
Molecular formulaC22H25NO3
IUPAC nameN-[3-[5-methoxy-2-[2-(3-methoxyphenyl)ethynyl]phenyl]propyl]propanamide
Molecular weight351.446
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP4.3
SynonymsN-[3-[2-[(3-Methoxyphenyl)ethynyl]-5-methoxyphenyl]propyl]propanamide
BDBM50426656
Inchi KeyABJOHSLYSRTJAR-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H25NO3/c1-4-22(24)23-14-6-8-19-16-21(26-3)13-12-18(19)11-10-17-7-5-9-20(15-17)25-2/h5,7,9,12-13,15-16H,4,6,8,14H2,1-3H3,(H,23,24)
PubChem CID71508232
ChEMBLCHEMBL2326200
IUPHARN/A
BindingDB50426656
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
912Melatonin receptor type 1AP48039MTNR1AHomo sapiens (Human)350
913Melatonin receptor type 1BP49286MTNR1BHomo sapiens (Human)362

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