fezolinetant
SMILES | Fc1ccc(cc1)C(=O)N1CCn2c([C@H]1C)nnc2c1snc(n1)C |
InChIKey | PPSNFPASKFYPMN-SECBINFHSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 0 |
Rotatable bonds | 2 |
Molecular weight (Da) | 358.1 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | Yes |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
NK3 | NK3R | Human | Tachykinin | A | pKi | 7.6 | 7.6 | 7.6 | Guide to Pharmacology |
NK3 | NK3R | Rat | Tachykinin | A | pKi | 6.66 | 6.66 | 6.66 | ChEMBL |
NK3 | NK3R | Human | Tachykinin | A | pKi | 7.6 | 7.62 | 7.64 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
NK3 | NK3R | Human | Tachykinin | A | pIC50 | 7.7 | 7.72 | 7.75 | ChEMBL |