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Ligand

NameCHEMBL43758
Molecular formulaC31H34Cl2N4O4S
IUPAC name2-[(2R,5R)-2-(2,3-dichlorophenyl)-3-[2-(3-morpholin-4-ylpropylamino)-2-oxoethyl]-4-oxo-1,3-thiazolidin-5-yl]-N-(naphthalen-1-ylmethyl)acetamide
Molecular weight629.597
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.5
Synonyms2-((1R,4R)-2-(2,3-Dichloro-phenyl)-5-{[(naphthalen-1-ylmethyl)-carbamoyl]-methyl}-4-oxo-thiazolidin-3-yl)-N-(3-morpholin-4-yl-propyl)-acetamide
BDBM50142373
Inchi KeyDWBNDBPNTDYBBR-MXBOTTGLSA-N
Inchi IDInChI=1S/C31H34Cl2N4O4S/c32-25-11-4-10-24(29(25)33)31-37(20-28(39)34-12-5-13-36-14-16-41-17-15-36)30(40)26(42-31)18-27(38)35-19-22-8-3-7-21-6-1-2-9-23(21)22/h1-4,6-11,26,31H,5,12-20H2,(H,34,39)(H,35,38)/t26-,31-/m1/s1
PubChem CID44288827
ChEMBLCHEMBL43758
IUPHARN/A
BindingDB50142373
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
70450C-C chemokine receptor type 4P51679CCR4Homo sapiens (Human)360

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