CHEMBL3981665
SMILES | CCCN(Cc1ccc(OCCN2C(=O)CCC2=O)c(OC)c1)[C@H](C(=O)O)c1ccc(Cl)c(Cl)c1 |
InChIKey | AHSIVFOYWUGNCT-DEOSSOPVSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 12 |
Molecular weight (Da) | 522.1 |
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 |
CXCR3 | CXCR3 | Human | Chemokine | A | pIC50 | 6.3 | 6.3 | 6.3 | ChEMBL |