| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2010 | 27 | Yes |
| 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) | 2.96 | 6.28 | -26.82 | 1 | 7 | 0 | 92 | 447.007 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.14 | 4.69 | -57.37 | 0 | 7 | -1 | 99 | 445.999 | 6 | ↓ |
![N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]isonipecotamide](http://zinc12.docking.org/img/rings/543346.gif)
