CHEMBL3893197
SMILES | c1cnc2c(N3CCN(CCCCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 |
InChIKey | HKPKDTNLXGOYIC-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 0 |
Rotatable bonds | 11 |
Molecular weight (Da) | 500.4 |
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 |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 7.3 | 7.3 | 7.3 | ChEMBL |
H1 | HRH1 | Human | Histamine | A | pKd | 8.3 | 8.3 | 8.3 | ChEMBL |
H1 | HRH1 | Human | Histamine | A | pKi | 7.8 | 7.8 | 7.8 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 9.2 | 9.2 | 9.2 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 7.1 | 7.1 | 7.1 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |