| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 18 | Yes |
Popular Name: (2S)-2-amino-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanoic (2S)-2-amino-3-(4-pyrimidin-2-yl…
| 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) | -2.70 | 4.11 | -38.5 | 3 | 7 | 0 | 100 | 251.29 | 4 | ↓ |
| Hi High (pH 8-9.5) | -2.70 | 3.34 | -45.58 | 2 | 7 | -1 | 98 | 250.282 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -2.70 | 5.97 | -87.32 | 4 | 7 | 1 | 101 | 252.298 | 4 | ↓ |
