MAZAPERTINE
SMILES | CC(C)Oc1ccccc1N1CCN(Cc2cccc(C(=O)N3CCCCC3)c2)CC1 |
InChIKey | ZKZFPRUSWCYSGT-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 6 |
Molecular weight (Da) | 421.3 |
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 | Rat | Dopamine | A | pKi | 8.74 | 8.74 | 8.74 | ChEMBL |
5-HT1B | 5HT1B | Rat | 5-Hydroxytryptamine | A | pKi | 5.54 | 5.54 | 5.54 | ChEMBL |
α1B | ADA1B | Rat | Adrenoceptors | A | pKi | 7.33 | 7.33 | 7.33 | ChEMBL |
5-HT1B | 5HT1B | Human | 5-Hydroxytryptamine | A | pKi | 5.54 | 5.54 | 5.54 | ChEMBL |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 7.33 | 7.33 | 7.33 | ChEMBL |
α1A | ADA1A | Rat | Adrenoceptors | A | pKi | 9.7 | 9.7 | 9.7 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 8.66 | 8.66 | 8.66 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 10.7 | 10.7 | 10.7 | ChEMBL |
5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pKi | 8.77 | 8.77 | 8.77 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 8.74 | 8.74 | 8.74 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 8.4 | 8.4 | 8.4 | PDSP Ki database |
5-HT1B | 5HT1B | Human | 5-Hydroxytryptamine | A | pKi | 5.54 | 5.54 | 5.54 | PDSP Ki database |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 7.33 | 7.33 | 7.33 | PDSP Ki database |
D2 | DRD2 | Human | Dopamine | A | pKi | 8.4 | 8.4 | 8.4 | PDSP Ki database |
D3 | DRD3 | Human | Dopamine | A | pKi | 8.4 | 8.4 | 8.4 | PDSP Ki database |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 8.77 | 8.77 | 8.77 | ChEMBL |
α1D | ADA1D | Human | Adrenoceptors | A | pKi | 10.7 | 10.7 | 10.7 | PDSP Ki database |
D2 | DRD2 | Human | Dopamine | A | pKi | 8.66 | 8.66 | 8.66 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |