| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2009 | 21 | Yes |
Popular Name: 4,6-dimethyl-2-[(2-oxo-2-piperazin-1-yl-ethyl)amino]pyridine-3-carboxamide 4,6-dimethyl-2-[(2-oxo-2-piperaz…
| 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) | -0.87 | 0.49 | -55.6 | 5 | 7 | 1 | 105 | 292.363 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.87 | -0.8 | -13.96 | 4 | 7 | 0 | 100 | 291.355 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.87 | -0.49 | -42.44 | 5 | 7 | 1 | 102 | 292.363 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.87 | 0.81 | -102.04 | 6 | 7 | 2 | 106 | 293.371 | 4 | ↓ |
