CHEMBL6019751 [450886]
CHEMBL6019751
| SMILES | CCOc1ccc(OC)c(C2(N3CC4(CN(C5CCN(C)CC5)C4)C3)C(=O)N(S(=O)(=O)c3ccc(OC)cc3OC)C3C=CC(C#N)=CC32)c1 |
| InChIKey | ZXXDTIHFUAMFKB-UHFFFAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 11 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 10 |
| Log P | 3.254 |
| Molecular weight (Da) | 703.3 |
| 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 |
CHEMBL6019751
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