| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 17 | Yes |
Popular Name: (2S)-2-amino-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]propan-1-one (2S)-2-amino-1-[4-[2-(dimethylam…
| 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) | -1.89 | 1.95 | -91.76 | 4 | 6 | 2 | 73 | 244.339 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.89 | 1.61 | -44.08 | 3 | 6 | 1 | 71 | 243.331 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.89 | -0.45 | -49.53 | 3 | 6 | 1 | 71 | 243.331 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.89 | -0.78 | -11.47 | 2 | 6 | 0 | 70 | 242.323 | 3 | ↓ |
