CHEMBL178447
SMILES | O=C(c1ccc2ncccc2c1)N1CCC(N2CC[C@H](Cc3ccc(Cl)c(Cl)c3)[C@H](CO)C2)CC1 |
InChIKey | BKSRLDUBSLBPQQ-OFNKIYASSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 511.2 |
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 | Rhesus macaque | Chemokine | A | pKi | 8.14 | 8.14 | 8.14 | ChEMBL |
CCR3 | CCR3 | Rat | Chemokine | A | pKi | 5.53 | 5.53 | 5.53 | ChEMBL |
CCR3 | CCR3 | Mouse | Chemokine | A | pKi | 6.22 | 6.22 | 6.22 | ChEMBL |
CCR3 | CCR3 | Human | Chemokine | A | pKi | 7.3 | 8.08 | 8.48 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |