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Ligand

NameCHEMBL2216804
Molecular formulaC30H30N2O4S
IUPAC nameN-[2-(3-ethoxy-4-methoxyphenyl)ethyl]-2-[(2S,5R)-4-oxo-2-[4-(2-phenylethynyl)phenyl]-1,3-thiazolidin-5-yl]acetamide
Molecular weight514.64
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP5.2
SynonymsBDBM50403051
Inchi KeyPRIDELZWTDTSFC-OFSOJUDTSA-N
Inchi IDInChI=1S/C30H30N2O4S/c1-3-36-26-19-23(13-16-25(26)35-2)17-18-31-28(33)20-27-29(34)32-30(37-27)24-14-11-22(12-15-24)10-9-21-7-5-4-6-8-21/h4-8,11-16,19,27,30H,3,17-18,20H2,1-2H3,(H,31,33)(H,32,34)/t27-,30+/m1/s1
PubChem CID71450781
ChEMBLCHEMBL2216804
IUPHARN/A
BindingDB50403051
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
266896Follicle-stimulating hormone receptorP23945FSHRHomo sapiens (Human)695

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