| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 19 | Yes |
Popular Name: 3-[4-(3,5-dioxo-2H-1,2,4-triazin-6-yl)piperazin-1-yl]propanoic 3-[4-(3,5-dioxo-2H-1,2,4-triazin…
| 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) | -1.58 | 1.99 | -51.89 | 3 | 9 | 0 | 126 | 269.261 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.12 | -1.93 | -85.66 | 1 | 9 | -2 | 128 | 267.245 | 4 | ↓ |
| Mid Mid (pH 6-8) | -1.12 | 0.3 | -70.28 | 2 | 9 | -1 | 130 | 268.253 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
