CHEMBL5831895 [413628]
CHEMBL5831895
| SMILES | Cc1c(-c2cccc(C(O)/C=C/[C@H]3CCC(=O)N3CCCc3ccc(C(=O)O)cc3)c2)ccc(Cl)c1Cl |
| InChIKey | XILYZDYREZOYEW-OFBHZCKMSA-N |
Chemical Properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 9 |
| Log P | 6.880 |
| Molecular weight (Da) | 537.1 |
| 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 |
CHEMBL5831895
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