| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 21 | Yes |
Popular Name: (2S)-2-amino-N-[5-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyridyl]propanamide (2S)-2-amino-N-[5-[4-(2-hydroxye…
| 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) | -1.04 | -2.68 | -53.18 | 5 | 7 | 1 | 96 | 294.379 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.04 | -3 | -15.68 | 4 | 7 | 0 | 95 | 293.371 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.04 | -0.31 | -93.63 | 6 | 7 | 2 | 98 | 295.387 | 5 | ↓ |
