Structure

InChI Key YQYFEGTYCUQBEI-UHFFFAOYSA-N
Smiles O=C(Nc1ccc(Cl)c(S(=O)(=O)N2CCNCC2)c1O)Nc1cccc(F)c1Cl
InChI
InChI=1S/C17H17Cl2FN4O4S/c18-10-4-5-13(23-17(26)22-12-3-1-2-11(20)14(12)19)15(25)16(10)29(27,28)24-8-6-21-7-9-24/h1-5,21,25H,6-9H2,(H2,22,23,26)

Physicochemical Descriptors

Property Name Value
Molecular Formula C17H17Cl2FN4O4S
Molecular Weight 463.32
AlogP 3.08
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 4.0
Polar Surface Area 110.77
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 29.0

Pharmacology

Mechanism of Action Action Reference
Interleukin-8 receptor B antagonist ANTAGONIST PubMed

Target Conservation

Protein: Interleukin-8 receptor B

Description: C-X-C chemokine receptor type 2

Organism : Homo sapiens

P25025 ENSG00000180871

Cross References

Resources Reference
ChEMBL CHEMBL2178579
DrugBank DB12135
FDA SRS MW2AIJ8USP
Guide to Pharmacology 8499
PubChem 10479502
SureChEMBL SCHEMBL1562280