| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2008 | 30 | No |
Popular Name: [2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]sulfanylmethylBLAHone [2-oxo-2-[4-(2-pyridyl)piperazin…
| 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) | 2.04 | 10.38 | -53.54 | 2 | 7 | 1 | 83 | 442.59 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.04 | 10.06 | -25.25 | 1 | 7 | 0 | 82 | 441.582 | 5 | ↓ |
