GSK 172981
SMILES | Fc1cccc(c1)c1nc2ccccc2c(c1N)C(=O)N[C@H](c1ccccc1)C1CC1 |
InChIKey | ZKGNLARKIMWKFE-XMMPIXPASA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 5 |
Molecular weight (Da) | 411.2 |
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 |
NK3 | NK3R | Human | Tachykinin | A | pKi | 8.0 | 8.0 | 8.0 | ChEMBL |
NK3 | NK3R | Human | Tachykinin | A | pKi | 8.0 | 8.0 | 8.0 | Guide to Pharmacology |
NK3 | NK3R | Guinea pig | Tachykinin | A | pKi | 8.11 | 8.11 | 8.11 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |