CHEMBL3343994
| SMILES | N=C(N)Nc1ccc(C[C@@H](N)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 |
| InChIKey | JGVSHHWPQVGYRT-CVEARBPZSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 6 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 368.2 |
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 |
| MRGPRX1 | MRGX1 | Mouse | A orphans | A | pEC50 | 5.9 | 5.9 | 5.9 | ChEMBL |
| MRGPRX1 | MRGX1 | Rat | A orphans | A | pEC50 | 6.2 | 6.2 | 6.2 | ChEMBL |