compound 18 [PMID: 17723296]
| SMILES | COc1cc(C#N)cc(c1)c1ncc2c(n1)nc(cc2)C |
| InChIKey | NGRPBCOEAPBKCI-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 2 |
| Molecular weight (Da) | 276.1 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |