CHEMBL5558065 [390785]
CHEMBL5558065
| SMILES | COc1ccc([C@H]2CN(Cc3cnn(S(C)(=O)=O)c3)CC[C@@H]2NC(=O)Nc2ccc(Cl)cc2)cc1 |
| InChIKey | VMMBGWVCYCGYLC-PKTZIBPZSA-N |
Chemical Properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 7 |
| Log P | 3.533 |
| Molecular weight (Da) | 517.2 |
| Stereochemistry info | full |
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 |
CHEMBL5558065
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