| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2010 | 16 | No |
Popular Name: (2R)-3-[4-(2-hydroxyethyl)piperazin-1-yl]-2-methyl-3-oxo-propanethioamide (2R)-3-[4-(2-hydroxyethyl)pipera…
| 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) | -1.41 | -1.78 | -15.96 | 3 | 5 | 0 | 70 | 245.348 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -1.41 | 0.51 | -43.3 | 4 | 5 | 1 | 71 | 246.356 | 4 | ↓ |
