CHEMBL68811 [468858]
CHEMBL68811
| SMILES | N=C(N)NCCC[C@H]1NC(=O)N(C(CCc2ccccc2)C(=O)N2CCC3(CCc4ccccc43)CC2)C1=O |
| InChIKey | RTYOPXGRXRGYCZ-IKOFQBKESA-N |
Chemical Properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 9 |
| Log P | 2.678 |
| Molecular weight (Da) | 530.3 |
| Stereochemistry info | unspecified |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
CHEMBL68811
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0