CHEMBL5940000 [443414]
CHEMBL5940000
| SMILES | C[C@@H]1CN(c2cccc3c2CN(C(=O)c2ccnn2C)CC3)CCN1C(=O)Cn1cnc2cccnc21 |
| InChIKey | ZTLXMWPHHGXLAV-LJQANCHMSA-N |
Chemical Properties
| Hydrogen bond acceptors | 8 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 4 |
| Log P | 2.101 |
| Molecular weight (Da) | 498.2 |
| 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 |
CHEMBL5940000
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