CHEMBL460644
SMILES | c1cnc(N2CCN(Cc3c[nH]c4ncccc34)CC2)nc1 |
InChIKey | AWKDBQYMZZKKJX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 294.2 |
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 |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.25 | 7.25 | 7.25 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 5.82 | 5.82 | 5.82 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.93 | 5.93 | 5.93 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.93 | 5.93 | 5.93 | PDSP Ki database |
D3 | DRD3 | Human | Dopamine | A | pKi | 5.82 | 5.82 | 5.82 | PDSP Ki database |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.25 | 7.25 | 7.25 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |