CHEMBL3968568 [298833]
CHEMBL3968568
| SMILES | O=C(N[C@H]1C[C@@H](c2cccc(F)c2F)CN(CC2CCC2)C1=O)c1cnc2c(c1)C[C@@]1(C2)C(=O)Nc2ncccc21 |
| InChIKey | SUKIQFSJOWYYTQ-XMBZSLMXSA-N |
Chemical Properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 5 |
| Log P | 3.658 |
| Molecular weight (Da) | 557.2 |
| Stereochemistry info | partial |
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 |
CHEMBL3968568
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