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Ligand

NameCHEMBL1085258
Molecular formulaC29H28N2O4S
IUPAC nameN-benzyl-4-[[benzyl-(4-methoxyphenyl)sulfonylamino]methyl]benzamide
Molecular weight500.613
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.8
SynonymsBDBM50320135
N-benzyl-4-((N-benzyl-4-methoxyphenylsulfonamido)methyl)benzamide
SCHEMBL12863085
Inchi KeyAHMFXDVNFSUGOJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H28N2O4S/c1-35-27-16-18-28(19-17-27)36(33,34)31(21-24-10-6-3-7-11-24)22-25-12-14-26(15-13-25)29(32)30-20-23-8-4-2-5-9-23/h2-19H,20-22H2,1H3,(H,30,32)
PubChem CID44253727
ChEMBLCHEMBL1085258
IUPHARN/A
BindingDB50320135
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
5693C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368

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