| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 3rd, 2011 | 22 | No |
Popular Name: N-[[3-(methylsulfonylmethyl)phenyl]methyl]-2-thioxo-1H-pyridine-3-carboxamide N-[[3-(methylsulfonylmethyl)phen…
| 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) | 1.32 | 3.56 | -69.15 | 1 | 5 | -1 | 76 | 335.43 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.32 | 3.02 | -20.11 | 1 | 5 | 0 | 76 | 336.438 | 5 | ↓ |
