CHEMBL5542770 [390493]
CHEMBL5542770
| SMILES | CC1(CNC(=O)[C@H]2[C@@H]3CC[C@@H](C3)[C@H]2N2CCc3cc(F)c(O[C@H]4CC[C@@](C)(C(=O)O)CC4)cc3C2=O)CCC1 |
| InChIKey | JGLMSPGHRXWNOV-OIVIFXHFSA-N |
Chemical Properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 7 |
| Log P | 4.957 |
| Molecular weight (Da) | 540.3 |
| 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 |
CHEMBL5542770
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