| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 19 | Yes |
Popular Name: 1-(3,5-dioxo-2H-1,2,4-triazin-6-yl)-4-ethyl-piperidine-4-carboxylic 1-(3,5-dioxo-2H-1,2,4-triazin-6-…
| 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) | -0.39 | 2.08 | -46.42 | 2 | 8 | -1 | 122 | 267.265 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.07 | 0.39 | -90.14 | 1 | 8 | -2 | 125 | 266.257 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.39 | 0.22 | -9.48 | 3 | 8 | 0 | 119 | 268.273 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
