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Ligand

NameCHEMBL220860
Molecular formulaC17H18ClN5O3S
IUPAC name1-[4-chloro-3-(dimethylsulfamoyl)-2-hydroxyphenyl]-3-cyano-2-(2-methylphenyl)guanidine
Molecular weight407.873
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP3.7
Synonyms6-chloro-3-({(cyanoimino)[(2-methylphenyl)amino]methyl}amino)-2-hydroxy-N,N-dimethylbenzenesulfonamide
BDBM50193986
Inchi KeyCBIODTKCFBGXHU-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H18ClN5O3S/c1-11-6-4-5-7-13(11)21-17(20-10-19)22-14-9-8-12(18)16(15(14)24)27(25,26)23(2)3/h4-9,24H,1-3H3,(H2,20,21,22)
PubChem CID44419439
ChEMBLCHEMBL220860
IUPHARN/A
BindingDB50193986
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
37912C-X-C chemokine receptor type 1P25024CXCR1Homo sapiens (Human)350
37911C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360

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