CHEMBL5844477 [424581]
CHEMBL5844477
| SMILES | COc1cc(-c2cn(CC(=O)Nc3cc(N4CCOCC4)ncc3Cl)c3nc(C)n(C)c(=O)c23)cc(C(N)=O)c1O |
| InChIKey | VMXZYKPFUSBLSX-UHFFFAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 11 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 7 |
| Log P | 2.047 |
| Molecular weight (Da) | 581.2 |
| 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 |
CHEMBL5844477
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