A331440
SMILES | N#Cc1ccc(cc1)c1ccc(cc1)OCCCN1CC[C@H](C1)N(C)C |
InChIKey | FXIPXWLVYIHFEP-OAQYLSRUSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 7 |
Molecular weight (Da) | 349.2 |
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 |
H3 | HRH3 | Human | Histamine | A | pKi | 8.5 | 8.5 | 8.5 | Guide to Pharmacology |
H1 | HRH1 | Human | Histamine | A | pKi | 5.72 | 5.72 | 5.72 | ChEMBL |
H2 | HRH2 | Human | Histamine | A | pKi | 5.0 | 5.0 | 5.0 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 8.4 | 8.55 | 8.7 | ChEMBL |
H3 | HRH3 | Rat | Histamine | A | pKi | 7.87 | 7.87 | 7.87 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |