CHEMBL5562578 [391048]
CHEMBL5562578
| SMILES | CCCCCCNC(=O)/C=C/c1ccc(Nc2nc3ccccc3c3[nH]c(C(CCC)CCC)nc23)cc1 |
| InChIKey | IKPQRXHRXPMFJD-DYTRJAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 14 |
| Log P | 8.248 |
| Molecular weight (Da) | 511.3 |
| 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 |
CHEMBL5562578
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