CHEMBL2112339
SMILES | Cc1cccc(OCCCCCCN2CCN(C)CC2)c1-n1c(C)nnc1-c1ccc(-c2ccccc2)cc1 |
InChIKey | WYFKUBJWMBRINL-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 0 |
Rotatable bonds | 11 |
Molecular weight (Da) | 523.3 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
V1A | V1AR | Rat | Vasopressin and oxytocin | A | pKi | 6.99 | 6.99 | 6.99 | ChEMBL |
V2 | V2R | Rat | Vasopressin and oxytocin | A | pKi | 4.93 | 4.93 | 4.93 | ChEMBL |
V2 | V2R | Human | Vasopressin and oxytocin | A | pKi | 4.84 | 4.84 | 4.84 | ChEMBL |
V1A | V1AR | Human | Vasopressin and oxytocin | A | pKi | 8.84 | 8.84 | 8.84 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |