| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 20 | No |
Popular Name: 1-(4-methyl-1-piperidyl)-2-[(5-nitro-2-pyridyl)sulfanyl]ethanone 1-(4-methyl-1-piperidyl)-2-[(5-n…
| 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) | 2.27 | 7.62 | -9.18 | 0 | 6 | 0 | 79 | 295.364 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.27 | 7.89 | -46.5 | 1 | 6 | 1 | 80 | 296.372 | 4 | ↓ |
