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Ligand

NameCHEMBL297854
Molecular formulaC27H29Cl2N3O2S
IUPAC name2-[(2R,5R)-2-(2,4-dichlorophenyl)-3-[3-(dimethylamino)propyl]-4-oxo-1,3-thiazolidin-5-yl]-N-(naphthalen-1-ylmethyl)acetamide
Molecular weight530.508
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.5
SynonymsBDBM50142357
2-[(2R,5R)-2-(2,4-Dichloro-phenyl)-3-(3-dimethylamino-propyl)-4-oxo-thiazolidin-5-yl]-N-naphthalen-1-ylmethyl-acetamide
Inchi KeyDQBBVQXMZLHEOK-SHQCIBLASA-N
Inchi IDInChI=1S/C27H29Cl2N3O2S/c1-31(2)13-6-14-32-26(34)24(35-27(32)22-12-11-20(28)15-23(22)29)16-25(33)30-17-19-9-5-8-18-7-3-4-10-21(18)19/h3-5,7-12,15,24,27H,6,13-14,16-17H2,1-2H3,(H,30,33)/t24-,27-/m1/s1
PubChem CID44288897
ChEMBLCHEMBL297854
IUPHARN/A
BindingDB50142357
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
66114C-C chemokine receptor type 4P51679CCR4Homo sapiens (Human)360

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