CHEMBL3797955
| SMILES | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3ccc(C#N)cn3)C3CC3)c2=O)cc1C |
| InChIKey | BITICEVAOACCIQ-GOSISDBHSA-N |
Chemical properties
| Hydrogen bond acceptors | 9 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 466.2 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |