VUF-5297
SMILES | N[C@H]1C[C@@H]1c1c[nH]cn1 |
InChIKey | OWWNABDDYQLERE-WHFBIAKZSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 2 |
Rotatable bonds | 1 |
Molecular weight (Da) | 123.1 |
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 | Rat | Histamine | A | pKi | 7.6 | 8.24 | 8.76 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 8.03 | 8.03 | 8.03 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H4 | HRH4 | Human | Histamine | A | pEC50 | 5.15 | 5.15 | 5.15 | ChEMBL |
H2 | HRH2 | Human | Histamine | A | pEC50 | 6.16 | 6.16 | 6.16 | ChEMBL |
H1 | HRH1 | Human | Histamine | A | pEC50 | 6.06 | 6.06 | 6.06 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pEC50 | 7.38 | 7.8 | 8.23 | ChEMBL |