| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 20 | Yes |
Popular Name: (2S,3S)-2-amino-3-methyl-1-[4-[[(2S)-tetrahydrofuran-2-yl]methyl]piperazin-1-yl]pentan-1-one (2S,3S)-2-amino-3-methyl-1-[4-[[…
| 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) | 0.42 | 2.22 | -44.17 | 3 | 5 | 1 | 60 | 284.424 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.42 | 1.92 | -7.13 | 2 | 5 | 0 | 59 | 283.416 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.42 | 4.53 | -99.05 | 4 | 5 | 2 | 62 | 285.432 | 5 | ↓ |
