compound 42 [PMID: 17189691]
| SMILES | O=C(C1CC=Cc2c1[nH]c(=O)o2)Nc1cccc(n1)C |
| InChIKey | ILTICRNSZLAODU-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 2 |
| Molecular weight (Da) | 271.1 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |