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Ligand

NameCHEMBL523044
Molecular formulaC33H42FN5O
IUPAC nameN-[[4-fluoro-3-[3-[(3-methylpiperazin-1-yl)methyl]phenyl]phenyl]methyl]-3-[(4-methyl-1,4-diazepan-1-yl)methyl]benzamide
Molecular weight543.731
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.0
SynonymsBDBM50413459
Inchi KeyAJBGYCZPYITRRR-UHFFFAOYSA-N
Inchi IDInChI=1S/C33H42FN5O/c1-25-22-39(15-12-35-25)24-27-6-3-8-29(18-27)31-20-26(10-11-32(31)34)21-36-33(40)30-9-4-7-28(19-30)23-38-14-5-13-37(2)16-17-38/h3-4,6-11,18-20,25,35H,5,12-17,21-24H2,1-2H3,(H,36,40)
PubChem CID56656712
ChEMBLN/A
IUPHARN/A
BindingDB50413459
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
6742Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590

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