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Ligand

NameCHEMBL233046
Molecular formulaC24H27Cl2N7O
IUPAC name[4-[4-[(2,4-dichlorophenyl)methylamino]pyrido[2,3-d]pyrimidin-2-yl]piperazin-1-yl]-[(2S)-piperidin-2-yl]methanone
Molecular weight500.428
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP4.1
SynonymsBDBM50198429
(S)-(4-(4-(2,4-dichlorobenzylamino)pyrido[2,3-d]pyrimidin-2-yl)piperazin-1-yl)(piperidin-2-yl)methanone
Inchi KeyGDQQUDANFRCFMF-FQEVSTJZSA-N
Inchi IDInChI=1S/C24H27Cl2N7O/c25-17-7-6-16(19(26)14-17)15-29-22-18-4-3-9-28-21(18)30-24(31-22)33-12-10-32(11-13-33)23(34)20-5-1-2-8-27-20/h3-4,6-7,9,14,20,27H,1-2,5,8,10-13,15H2,(H,28,29,30,31)/t20-/m0/s1
PubChem CID44430312
ChEMBLCHEMBL233046
IUPHARN/A
BindingDB50198429
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
93889C-C chemokine receptor type 4P51679CCR4Homo sapiens (Human)360
93890C-C chemokine receptor type 4P51680Ccr4Mus musculus (Mouse)360

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