CHEMBL1258383
SMILES | Cc1ccc(C)c(N2CCN(CCCCNC(=O)c3cc4ccccc4s3)CC2)c1 |
InChIKey | CEGIBPCCIZOPHK-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 421.2 |
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 |
D1 | DRD1 | Pig | Dopamine | A | pKi | 5.62 | 5.62 | 5.62 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.52 | 6.52 | 6.52 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 8.6 | 8.6 | 8.6 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.08 | 7.13 | 7.19 | ChEMBL |
5-HT2A | 5HT2A | Pig | 5-Hydroxytryptamine | A | pKi | 5.82 | 5.82 | 5.82 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |