GW803430
| SMILES | COc1cc(ccc1OCCN1CCCC1)n1cnc2c(c1=O)sc(c2)c1ccc(cc1)Cl |
| InChIKey | MWULMTACIBZPGN-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 7 |
| Molecular weight (Da) | 481.1 |
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 |
| MCH1 | MCHR1 | Rat | Melanin-concentrating hormone | A | pKi | 9.47 | 9.47 | 9.47 | ChEMBL |
| 5-HT1D | 5HT1D | Human | 5-Hydroxytryptamine | A | pKi | 5.45 | 5.45 | 5.45 | ChEMBL |
| α1D | ADA1D | Human | Adrenoceptors | A | pKi | 5.22 | 5.22 | 5.22 | ChEMBL |
| M5 | ACM5 | Human | Acetylcholine (muscarinic) | A | pKi | 5.58 | 5.58 | 5.58 | ChEMBL |
| MCH1 | MCHR1 | Human | Melanin-concentrating hormone | A | pKi | 8.55 | 8.61 | 8.66 | ChEMBL |
| α2A | ADA2A | Human | Adrenoceptors | A | pKi | 5.53 | 5.53 | 5.53 | ChEMBL |
| 5-HT2C | 5HT2C | Human | 5-Hydroxytryptamine | A | pKi | 6.05 | 6.05 | 6.05 | ChEMBL |
| M1 | ACM1 | Human | Acetylcholine (muscarinic) | A | pKi | 5.91 | 5.91 | 5.91 | ChEMBL |
| D3 | DRD3 | Human | Dopamine | A | pKi | 6.12 | 6.12 | 6.12 | ChEMBL |
| 5-HT2B | 5HT2B | Human | 5-Hydroxytryptamine | A | pKi | 6.28 | 6.28 | 6.28 | ChEMBL |
| 5-HT5A | 5HT5A | Human | 5-Hydroxytryptamine | A | pKi | 6.25 | 6.25 | 6.25 | ChEMBL |
| M3 | ACM3 | Human | Acetylcholine (muscarinic) | A | pKi | 5.38 | 5.38 | 5.38 | ChEMBL |
| M4 | ACM4 | Human | Acetylcholine (muscarinic) | A | pKi | 5.77 | 5.77 | 5.77 | ChEMBL |
| H3 | HRH3 | Human | Histamine | A | pKi | 6.68 | 6.68 | 6.68 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| MCH1 | MCHR1 | Human | Melanin-concentrating hormone | A | pIC50 | 9.3 | 9.3 | 9.3 | Guide to Pharmacology |
| MCH1 | MCHR1 | Human | Melanin-concentrating hormone | A | pIC50 | 7.05 | 8.36 | 9.3 | ChEMBL |