CHEMBL4465109
SMILES | CCCN1CCO[C@@H]2c3cc(OCCCCNC(=O)c4cc5ccccc5o4)ccc3OC[C@H]21 |
InChIKey | ISOJUHYODLHLNP-ATIYNZHBSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 9 |
Molecular weight (Da) | 464.2 |
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 |
D3 | DRD3 | Human | Dopamine | A | pKi | 5.22 | 5.22 | 5.22 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.03 | 5.03 | 5.03 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |