L-366,682
SMILES | CC(C=C)C(C(=O)N1CCCCC1(C=O)C(=O)N2CCCCC2)NC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)C5CCCN5C(=O)C(CC6=CN=CN6)N |
InChIKey | QHUGACUEEILSLD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 5 |
Rotatable bonds | 14 |
Molecular weight (Da) | 755.4 |
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 |
OT | OXYR | Rat | Vasopressin and oxytocin | A | pKi | 8.0 | 8.11 | 8.22 | PDSP Ki database |
OT | OXYR | Human | Vasopressin and oxytocin | A | pKi | 8.03 | 8.03 | 8.03 | PDSP Ki database |
V2 | V2R | Rat | Vasopressin and oxytocin | A | pKi | 5.51 | 5.62 | 5.74 | PDSP Ki database |
OT | OXYR | Rhesus macaque | Vasopressin and oxytocin | A | pKi | 7.77 | 7.77 | 7.77 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |