CHEMBL2381332
SMILES | COc1ccccc1C(CNC(=O)c1cc(-c2ccc(Br)cc2)on1)N1CCC(C)CC1 |
InChIKey | KXJLNPLYEOWYLU-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 497.1 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
ACKR3 | ACKR3 | Human | Chemokine | A | pIC50 | 5.73 | 5.73 | 5.73 | ChEMBL |
CCR5 | CCR5 | Human | Chemokine | A | pIC50 | 5.72 | 5.72 | 5.72 | ChEMBL |