SCH-23390
SMILES | CN1CCc2cc(Cl)c(O)cc2[C@@H](c2ccccc2)C1 |
InChIKey | GOTMKOSCLKVOGG-OAHLLOKOSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 1 |
Rotatable bonds | 1 |
Molecular weight (Da) | 287.1 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D1 | DRD1 | Mouse | Dopamine | A | pKi | 9.4 | 9.4 | 9.4 | ChEMBL |
D1 | DRD1 | Goldfish | Dopamine | A | pKi | 8.89 | 8.89 | 8.89 | ChEMBL |
D2 | DRD2 | Mouse | Dopamine | A | pKi | 5.92 | 5.92 | 5.92 | ChEMBL |
D1 | DRD1 | Pig | Dopamine | A | pKi | 9.3 | 9.3 | 9.3 | ChEMBL |
D1 | DRD1 | Bovine | Dopamine | A | pKi | 7.43 | 8.75 | 10.0 | ChEMBL |
D3 | DRD3 | Rat | Dopamine | A | pKi | 6.12 | 6.12 | 6.12 | ChEMBL |
5-HT2C | 5HT2C | Rat | 5-Hydroxytryptamine | A | pKi | 7.9 | 7.9 | 7.9 | ChEMBL |
D5 | DRD5 | Human | Dopamine | A | pKi | 8.09 | 9.05 | 9.77 | ChEMBL |
D1 | DRD1 | Rat | Dopamine | A | pKi | 6.17 | 9.19 | 9.92 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 6.05 | 6.52 | 9.27 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKd | 9.42 | 9.42 | 9.42 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKi | 7.62 | 9.38 | 10.0 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.0 | 6.03 | 6.05 | ChEMBL |
5-HT2C | K7GSR7 | Pig | 5-Hydroxytryptamine | A | pKi | 5.27 | 7.86 | 8.3 | PDSP Ki database |
5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pKi | 6.58 | 6.58 | 6.58 | PDSP Ki database |
5-HT1A | A0A4X1UTF5 | Pig | 5-Hydroxytryptamine | A | pKi | 6.47 | 6.47 | 6.47 | PDSP Ki database |
5-HT1D | F1MMU1 | Bovine | 5-Hydroxytryptamine | A | pKi | 5.4 | 5.43 | 5.5 | PDSP Ki database |
5-HT1B | 5HT1B | Rat | 5-Hydroxytryptamine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
5-HT2A | 5HT2A | Rat | 5-Hydroxytryptamine | A | pKi | 7.7 | 7.95 | 8.07 | PDSP Ki database |
5-HT2C | 5HT2C | Rat | 5-Hydroxytryptamine | A | pKi | 7.87 | 7.87 | 7.87 | PDSP Ki database |
5-HT6 | 5HT6R | Mouse | 5-Hydroxytryptamine | A | pKi | 5.6 | 5.6 | 5.6 | PDSP Ki database |
D1 | DRD1 | Bovine | Dopamine | A | pKi | 5.0 | 7.12 | 9.24 | PDSP Ki database |
D2 | DRD2 | Rat | Dopamine | A | pKi | 5.25 | 5.72 | 6.44 | PDSP Ki database |
D5 | DRD5 | Rat | Dopamine | A | pKi | 9.0 | 9.16 | 9.33 | PDSP Ki database |
D1 | DRD1 | Rat | Dopamine | A | pKi | 6.75 | 9.3 | 9.92 | PDSP Ki database |
5-HT2B | 5HT2B | Rat | 5-Hydroxytryptamine | A | pKi | 7.08 | 7.08 | 7.08 | PDSP Ki database |
D1 | DRD1 | Human | Dopamine | A | pKi | 9.46 | 9.46 | 9.46 | PDSP Ki database |
D5 | DRD5 | Human | Dopamine | A | pKi | 9.52 | 9.52 | 9.52 | PDSP Ki database |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.67 | 5.86 | 6.04 | PDSP Ki database |
D4 | DRD4 | Human | Dopamine | A | pKi | 5.45 | 5.45 | 5.45 | PDSP Ki database |
D2 | DRD2 | Mouse | Dopamine | A | pKi | 6.05 | 6.05 | 6.05 | PDSP Ki database |
D1 | DRD1 | Mouse | Dopamine | A | pKi | 9.85 | 9.85 | 9.85 | PDSP Ki database |
D1 | DRD1 | Rhesus macaque | Dopamine | A | pKi | 8.89 | 9.05 | 9.22 | PDSP Ki database |
D3 | DRD3 | Human | Dopamine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 7.88 | 7.88 | 7.88 | PDSP Ki database |
5-HT2B | 5HT2B | Human | 5-Hydroxytryptamine | A | pKi | 7.15 | 7.15 | 7.15 | PDSP Ki database |
5-HT2C | 5HT2C | Human | 5-Hydroxytryptamine | A | pKi | 7.39 | 7.39 | 7.39 | PDSP Ki database |
H1 | HRH1 | Human | Histamine | A | pKi | 7.0 | 7.0 | 7.0 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D5 | DRD5 | Human | Dopamine | A | pIC50 | 8.96 | 9.4 | 9.82 | ChEMBL |
D1 | DRD1 | Rat | Dopamine | A | pIC50 | 8.37 | 8.9 | 9.24 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pIC50 | 5.72 | 5.97 | 6.22 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pIC50 | 6.28 | 8.57 | 9.66 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pIC50 | 5.69 | 6.93 | 7.59 | ChEMBL |
TSH | TSHR | Human | Glycoprotein hormone | A | Potency | 4.6 | 4.6 | 4.6 | ChEMBL |