CHEMBL20539
SMILES | O=C(CSc1nc2ccccc2s1)NC1CCN(Cc2ccccc2)CC1 |
InChIKey | LHFVURFEDUAKJQ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 397.1 |
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 |
CCR1 | CCR1 | Human | Chemokine | A | pIC50 | 5.15 | 5.15 | 5.15 | ChEMBL |
CCR3 | CCR3 | Human | Chemokine | A | pIC50 | 6.12 | 6.12 | 6.12 | ChEMBL |