CHEMBL399495
SMILES | C[C@@H](NC(=O)Nc1cccc(-c2nnnn2C)c1)[C@@H](O)CN1CCC[C@@H](Cc2ccc(F)cc2)C1 |
InChIKey | JTVSGNGYUGCQJP-FHJLPGHOSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 3 |
Rotatable bonds | 8 |
Molecular weight (Da) | 481.3 |
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 |
CCR3 | CCR3 | Crab-eating macaque | Chemokine | A | pIC50 | 9.82 | 9.82 | 9.82 | ChEMBL |
CCR3 | CCR3 | Mouse | Chemokine | A | pIC50 | 7.51 | 7.51 | 7.51 | ChEMBL |
CCR3 | CCR3 | Human | Chemokine | A | pIC50 | 9.06 | 9.69 | 10.42 | ChEMBL |