| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2009 | 17 | Yes |
Popular Name: (2S,3S)-2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methyl-pentan-1-one (2S,3S)-2-amino-1-[4-(2-hydroxye…
| 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) | -0.59 | -1.39 | -44.64 | 4 | 5 | 1 | 71 | 244.359 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.59 | -1.74 | -8.76 | 3 | 5 | 0 | 70 | 243.351 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.59 | 0.92 | -97.71 | 5 | 5 | 2 | 73 | 245.367 | 5 | ↓ |
