CHEMBL4519520
SMILES | CCCN1CCO[C@@H]2c3cc(OCCCCNC(=O)c4cc5ccccc5[nH]4)ccc3OC[C@H]21 |
InChIKey | AROFXNYQCSFIME-AOYPEHQESA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 9 |
Molecular weight (Da) | 463.2 |
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 |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.21 | 6.21 | 6.21 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.41 | 5.41 | 5.41 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |