| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 21 | Yes |
Popular Name: N-allyl-2-[4-[(2S,3R)-2-amino-3-methyl-pentanoyl]piperazin-1-yl]acetamide N-allyl-2-[4-[(2S,3R)-2-amino-3-…
| 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) | 0.30 | 1.07 | -48.86 | 4 | 6 | 1 | 80 | 297.423 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.30 | 0.78 | -12.11 | 3 | 6 | 0 | 79 | 296.415 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.30 | 3.21 | -105.11 | 5 | 6 | 2 | 81 | 298.431 | 7 | ↓ |
