Table 2. Properties of the fragment hits.
Properties are according to the NCI browser database (https://cactus.nci.nih.gov/ncidb2.2/).
| Compound | Molecular mass (Da) | Hydrogen-bond acceptors/donors | LogP | Rotatable bonds |
|---|---|---|---|---|
| Sulfaguanidine | 214.2 | 4/4 | −1.07 | 3 |
| Fragment 18 | 188.2 | 5/3 | −1.03 | 1 |
| Fragment 20 | 172.2 | 4/2 | −0.55 | 1 |
| Fragment 24 | 173.2 | 4/2 | 0.25 | 2 |
| Fragment 26 | 215.3 | 5/3 | −0.45 | 3 |
| Fragment 34 | 172.2 | 4/2 | −0.55 | 1 |
| Fragment 39 | 173.2 | 4/3 | −0.65 | 1 |
| Fragment 50 | 233.3 | 4/2 | 1.49 | 2 |
| Fragment 76 | 187.2 | 4/1 | 1.07 | 3 |
| Fragment 78 | 201.2 | 4/0 | 1.28 | 3 |
| Fragment 86 | 235.7 | 4/0 | 1.93 | 3 |