| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 15 | Yes |
Popular Name: (2S)-2-[2-hydroxyethyl(methyl)amino]-1-piperazin-1-yl-propan-1-one (2S)-2-[2-hydroxyethyl(methyl)am…
| 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) | -1.31 | -0.93 | -33.79 | 3 | 5 | 1 | 57 | 216.305 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.31 | -3.31 | -11.82 | 2 | 5 | 0 | 56 | 215.297 | 4 | ↓ |
| Mid Mid (pH 6-8) | -1.31 | 0.46 | -95.18 | 4 | 5 | 2 | 62 | 217.313 | 4 | ↓ |
