CHEMBL3355956
SMILES | CCc1c(C2CCN(CCCSc3ccc(F)cc3)CC2)c2ccc(F)cc2n1-c1ccc(C(=O)O)cn1 |
InChIKey | YUCBOQQXHCEAOT-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 9 |
Molecular weight (Da) | 535.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CCR3 | CCR3 | Rat | Chemokine | A | pKi | 5.96 | 5.96 | 5.96 | ChEMBL |
CCR3 | CCR3 | Mouse | Chemokine | A | pKi | 6.2 | 6.2 | 6.2 | ChEMBL |
CCR3 | CCR3 | Human | Chemokine | A | pKi | 7.8 | 7.8 | 7.8 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CCR3 | CCR3 | Human | Chemokine | A | pIC50 | 6.27 | 6.83 | 7.4 | ChEMBL |