CHEMBL6008178 [449797]
CHEMBL6008178
| SMILES | CCCCc1nc(O)c(-c2nnc(CC(=O)NCCc3ccc(S(N)(=O)=O)cc3)o2)c(O)c1-c1c(OC)cccc1OC |
| InChIKey | VKVACLNUMVNKAR-UHFFFAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 11 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 13 |
| Log P | 3.118 |
| Molecular weight (Da) | 611.2 |
| 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 |
CHEMBL6008178
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