OXEDRINE
SMILES | CNCC(O)c1ccc(O)cc1 |
InChIKey | YRCWQPVGYLYSOX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 3 |
Rotatable bonds | 3 |
Molecular weight (Da) | 167.1 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 4.2 | 4.2 | 4.2 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 8.38 | 8.38 | 8.38 | Drug Central |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
M1 | ACM1 | Rat | Acetylcholine (muscarinic) | A | Potency | 5.85 | 5.85 | 5.85 | ChEMBL |
NMU2 | NMUR2 | Human | Neuromedin U | A | pEC50 | 8.29 | 8.29 | 8.29 | Drug Central |
NMU2 | NMUR2 | Human | Neuromedin U | A | pEC50 | 5.18 | 5.18 | 5.18 | ChEMBL |