| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 23 | Yes |
Popular Name: 4-[[(2S)-1,4-dioxan-2-yl]methyl]-N-(3-pyridylmethyl)piperazine-1-carboxamide 4-[[(2S)-1,4-dioxan-2-yl]methyl]…
| 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) | 0.23 | 2.21 | -11.18 | 1 | 7 | 0 | 67 | 320.393 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.23 | 4.45 | -45.55 | 2 | 7 | 1 | 68 | 321.401 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
