| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2010 | 15 | No |
Popular Name: 3-[[[(3S)-1,1-dioxothiolan-3-yl]amino]methyl]-1,4-dihydro-1,2,4-triazol-5-one 3-[[[(3S)-1,1-dioxothiolan-3-yl]…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -1.78 | -3.71 | -20.75 | 3 | 7 | 0 | 108 | 232.265 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -1.32 | -6.18 | -73.39 | 4 | 7 | 1 | 113 | 233.273 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-[[(1,1-diketothiolan-3-yl)amino]methyl]-1,4-dihydro-1,2,4-triazol-5-one](http://zinc12.docking.org/img/rings/608196.gif)