| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 19 | Yes |
Popular Name: (2R)-2-amino-1-[4-(3-pyridylmethyl)piperazin-1-yl]butan-1-one (2R)-2-amino-1-[4-(3-pyridylmeth…
| 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) | -0.54 | 1.83 | -46.11 | 3 | 5 | 1 | 64 | 263.365 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.54 | 1.48 | -10.12 | 2 | 5 | 0 | 62 | 262.357 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.54 | 4.05 | -108.62 | 4 | 5 | 2 | 65 | 264.373 | 4 | ↓ |
