| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 20 | Yes |
Popular Name: (2S,3R)-2-amino-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]-3-methyl-pentan-1-one (2S,3R)-2-amino-1-[4-[2-(dimethy…
| 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) | -0.61 | 3.95 | -91.4 | 4 | 6 | 2 | 73 | 286.42 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.61 | 1.56 | -49 | 3 | 6 | 1 | 71 | 285.412 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.61 | 3.64 | -43.52 | 3 | 6 | 1 | 71 | 285.412 | 5 | ↓ |
