CHEMBL6168435 [467092]
CHEMBL6168435
| SMILES | O=C(O)c1cc2c(nc(CN3CCC(Oc4cccc(Cc5ccc6cnn(CC(F)F)c6c5)n4)CC3)n2C[C@@H]2CCO2)s1 |
| InChIKey | CURPUJHDCSZNLC-QHCPKHFHSA-N |
Chemical Properties
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 11 |
| Log P | 5.229 |
| Molecular weight (Da) | 622.2 |
| Stereochemistry info | full |
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 |
CHEMBL6168435
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