CHEMBL515170
SMILES | CC[C@@H]1O[C@](/C=C/C2CC2)(C(F)(F)F)c2c(ccc(F)c2F)NC1=O |
InChIKey | MSJCAWWJIHDUAU-OSTNNTLRSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 361.1 |
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 |
NK2 | NK2R | Human | Tachykinin | A | pIC50 | 4.55 | 4.55 | 4.55 | ChEMBL |
α1D | ADA1D | Human | Adrenoceptors | A | pIC50 | 4.86 | 4.86 | 4.86 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pIC50 | 4.98 | 4.98 | 4.98 | ChEMBL |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pIC50 | 4.82 | 4.82 | 4.82 | ChEMBL |
PTH1 | PTH1R | Human | Parathyroid hormone | B1 | pIC50 | 4.17 | 5.14 | 6.0 | ChEMBL |