A-304121
SMILES | C[C@H](C(=O)N1CCN(CC1)CCCOc1ccc(cc1)C(=O)C1CC1)N |
InChIKey | KPXVCGPCRXEDLT-OAHLLOKOSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 359.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Ligand site mutations | H3 |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H3 | HRH3 | Human | Histamine | A | pKi | 6.1 | 6.1 | 6.1 | Guide to Pharmacology |
H3 | HRH3 | Rat | Histamine | A | pKi | 8.6 | 8.6 | 8.6 | Guide to Pharmacology |
H2 | HRH2 | Human | Histamine | A | pKi | 4.15 | 4.15 | 4.15 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 6.1 | 6.12 | 6.12 | ChEMBL |
H1 | HRH1 | Human | Histamine | A | pKi | 4.16 | 4.16 | 4.16 | ChEMBL |
H3 | HRH3 | Rat | Histamine | A | pKi | 8.6 | 8.67 | 8.9 | ChEMBL |
H3 | HRH3 | Guinea pig | Histamine | A | pKd | 6.98 | 6.98 | 6.98 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |