| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 19 | Yes |
Popular Name: (2S)-N-[(6-methyl-3-pyridyl)methyl]-2-piperazin-1-yl-propanamide (2S)-N-[(6-methyl-3-pyridyl)meth…
| 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) | -0.71 | 1.5 | -42.96 | 3 | 5 | 1 | 62 | 263.365 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.71 | 0.14 | -8.83 | 2 | 5 | 0 | 57 | 262.357 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.71 | 1.93 | -81.13 | 4 | 5 | 2 | 63 | 264.373 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
