CHEMBL160932
SMILES | Cc1nn2c(C#N)cccc2c1CN1CCN(c2ccc(Cl)cc2)CC1 |
InChIKey | MFGYZKGJWDJWAA-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 0 |
Rotatable bonds | 3 |
Molecular weight (Da) | 365.1 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D1 | DRD1 | Bovine | Dopamine | A | pKi | 4.96 | 4.96 | 4.96 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 8.64 | 8.64 | 8.64 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 4.68 | 4.68 | 4.68 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 5.35 | 5.35 | 5.35 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 4.23 | 4.24 | 4.24 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D4 | DRD4 | Human | Dopamine | A | pEC50 | 7.92 | 7.92 | 7.92 | ChEMBL |