CHEMBL72372
SMILES | S=C(NCCCCCc1c[nH]cn1)NCc1ccc(Cl)cc1 |
InChIKey | HEMGHPXVGLAJGV-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 3 |
Rotatable bonds | 8 |
Molecular weight (Da) | 336.1 |
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 |
H3 | HRH3 | Guinea pig | Histamine | A | pKd | 8.1 | 8.1 | 8.1 | ChEMBL |
H4 | HRH4 | Human | Histamine | A | pKi | 6.9 | 6.9 | 6.9 | ChEMBL |
H2 | HRH2 | Human | Histamine | A | pKi | 5.8 | 5.8 | 5.8 | ChEMBL |
H1 | HRH1 | Guinea pig | Histamine | A | pKi | 5.8 | 5.8 | 5.8 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H4 | HRH4 | Human | Histamine | A | pEC50 | 7.2 | 7.2 | 7.2 | ChEMBL |