CHEMBL470432
SMILES | CCCN1CCC(COc2nc3scc(C)c3n3cccc23)CC1 |
InChIKey | FZGWDCDUMFWUEO-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 0 |
Rotatable bonds | 5 |
Molecular weight (Da) | 343.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
5-HT4 | 5HT4R | Guinea pig | 5-Hydroxytryptamine | A | pKi | 8.22 | 8.49 | 8.76 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
5-HT1D | 5HT1D | Rat | 5-Hydroxytryptamine | A | pIC50 | 5.34 | 5.34 | 5.34 | ChEMBL |
α1B | ADA1B | Human | Adrenoceptors | A | pIC50 | 6.84 | 6.84 | 6.84 | ChEMBL |
α1D | ADA1D | Human | Adrenoceptors | A | pIC50 | 6.69 | 6.69 | 6.69 | ChEMBL |
α2B | ADA2B | Human | Adrenoceptors | A | pIC50 | 6.02 | 6.02 | 6.02 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pIC50 | 6.13 | 6.13 | 6.13 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pIC50 | 7.13 | 7.13 | 7.13 | ChEMBL |
α2A | ADA2A | Human | Adrenoceptors | A | pIC50 | 6.05 | 6.05 | 6.05 | ChEMBL |
5-HT2B | 5HT2B | Human | 5-Hydroxytryptamine | A | pIC50 | 6.55 | 6.55 | 6.55 | ChEMBL |
5-HT2C | 5HT2C | Human | 5-Hydroxytryptamine | A | pIC50 | 7.14 | 7.14 | 7.14 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pIC50 | 5.3 | 5.3 | 5.3 | ChEMBL |