CHEMBL4250007
SMILES | NC(=O)c1ccc(-c2ccc(S(=O)(=O)[C@H]3CC[C@H](Nc4ccc(C(F)(F)F)cn4)CC3)cc2)cc1 |
InChIKey | FOKDJWFFZGBSDO-AQYVVDRMSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 6 |
Molecular weight (Da) | 503.1 |
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 |
CCR6 | H9YX08 | Rhesus macaque | Chemokine | A | pIC50 | 7.8 | 7.8 | 7.8 | ChEMBL |
CCR6 | CCR6 | Human | Chemokine | A | pIC50 | 7.39 | 7.64 | 7.89 | ChEMBL |