CHEMBL225512
SMILES | O=C(CCCCCN1CCN(c2ccccc2O)CC1)NC1CCCc2ccccc21 |
InChIKey | JYEKEEYIUIJIPG-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 8 |
Molecular weight (Da) | 421.3 |
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 |
5-HT7 | 5HT7R | Rat | 5-Hydroxytryptamine | A | pKi | 7.94 | 7.94 | 7.94 | ChEMBL |
5-HT7 | 5HT7R | Human | 5-Hydroxytryptamine | A | pKd | 7.2 | 7.2 | 7.2 | ChEMBL |
5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pKi | 7.62 | 7.62 | 7.62 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.01 | 6.01 | 6.01 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.01 | 6.01 | 6.01 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |