| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 19 | No |
Popular Name: 4-[[(3R)-1,1-dioxothian-3-yl]amino]-N-methyl-pyridine-2-carboxamide 4-[[(3R)-1,1-dioxothian-3-yl]ami…
| 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) | 0.61 | -0.22 | -48.18 | 3 | 6 | 1 | 89 | 284.361 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.61 | -0.71 | -17.61 | 2 | 6 | 0 | 88 | 283.353 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
