CHEMBL4516173
SMILES | N=C(N)N(CCCCN1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccc(Cl)cc1 |
InChIKey | SNDDKBQSRRYOPO-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 16 |
Molecular weight (Da) | 513.3 |
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 |
H1 | HRH1 | Guinea pig | Histamine | A | pKd | 6.62 | 6.62 | 6.62 | ChEMBL |
H3 | HRH3 | Rat | Histamine | A | pKi | 7.6 | 7.6 | 7.6 | ChEMBL |
H4 | HRH4 | Human | Histamine | A | pKi | 5.97 | 5.97 | 5.97 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 6.56 | 6.56 | 6.56 | ChEMBL |
H3 | HRH3 | Guinea pig | Histamine | A | pKd | 7.8 | 7.8 | 7.8 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |