CHEMBL603872
SMILES | COc1ccc(-c2cccc3c2CC[C@H]2[C@H]3c3cc(O)c(Cl)cc3CCN2C)cc1 |
InChIKey | PZVTYIIWLUKKIK-AZGAKELHSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 2 |
Molecular weight (Da) | 419.2 |
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 |
D5 | DRD5 | Human | Dopamine | A | pKi | 8.21 | 8.21 | 8.21 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 5.0 | 5.0 | 5.0 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKi | 9.15 | 9.15 | 9.15 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.26 | 6.26 | 6.26 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |