NEOCUPROINE
SMILES | Cc1ccc2ccc3ccc(C)nc3c2n1 |
InChIKey | IYRGXJIJGHOCFS-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 0 |
Rotatable bonds | 0 |
Molecular weight (Da) | 208.1 |
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 | pEC50 | 5.8 | 5.8 | 5.8 | ChEMBL |
CCR5 | CCR5 | Human | Chemokine | A | pEC50 | 4.17 | 4.19 | 4.2 | ChEMBL |
CCR5 | CCR5 | Human | Chemokine | A | pIC50 | 4.5 | 4.51 | 4.52 | ChEMBL |