CHEMBL5931227 [432798]
CHEMBL5931227
| SMILES | Cc1cnn(Cc2ccc(CCCC(=O)O)c(NC(=O)[C@@H](C)n3cc(C)c4ccc(C(=O)NC(C)C)cc43)c2)c1 |
| InChIKey | WNYNYJKTTPLKMD-JOCHJYFZSA-N |
Chemical Properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 11 |
| Log P | 5.248 |
| Molecular weight (Da) | 543.3 |
| 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 |
CHEMBL5931227
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