| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 24 | Yes |
Popular Name: (2S)-2-amino-N-[5-[4-(2-pyridyl)piperazin-1-yl]-2-pyridyl]propanamide (2S)-2-amino-N-[5-[4-(2-pyridyl)…
| 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) | 0.38 | 3.07 | -87.4 | 5 | 7 | 2 | 90 | 328.42 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.38 | 2.46 | -16.32 | 3 | 7 | 0 | 87 | 326.404 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.38 | 2.74 | -42.33 | 4 | 7 | 1 | 89 | 327.412 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.38 | 2.79 | -53.24 | 4 | 7 | 1 | 89 | 327.412 | 4 | ↓ |
