CHEMBL1096429
SMILES | C[C@@H](CC(=O)NC(=N)NCCCc1c[nH]cn1)c1ccccc1 |
InChIKey | NTHUVTORAXKPJS-ZDUSSCGKSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 4 |
Rotatable bonds | 7 |
Molecular weight (Da) | 313.2 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H4 | HRH4 | Human | Histamine | A | pEC50 | 8.58 | 8.58 | 8.58 | ChEMBL |
H2 | HRH2 | Human | Histamine | A | pEC50 | 7.1 | 7.1 | 7.1 | ChEMBL |
H1 | HRH1 | Human | Histamine | A | pEC50 | 6.08 | 6.08 | 6.08 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pEC50 | 8.73 | 8.73 | 8.73 | ChEMBL |