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Ligand

NameCXCR2-IN-1
Molecular formulaC19H20Cl2FN3O4S
IUPAC name1-(2-chloro-3-fluorophenyl)-3-[4-chloro-2-hydroxy-3-(1-methylpiperidin-4-yl)sulfonylphenyl]urea
Molecular weight476.344
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP3.9
SynonymsCHEMBL3819512
HY-101022
BDBM50182251
CS-6467
1873376-49-8
[ Show all ]
Inchi KeyBJYOBCUGMDKPBM-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H20Cl2FN3O4S/c1-25-9-7-11(8-10-25)30(28,29)18-12(20)5-6-15(17(18)26)24-19(27)23-14-4-2-3-13(22)16(14)21/h2-6,11,26H,7-10H2,1H3,(H2,23,24,27)
PubChem CID127020968
ChEMBLCHEMBL3819512
IUPHARN/A
BindingDB50182251
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
522333C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360

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