| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2014 | 9 | Yes |
Popular Name: 2,5-Piperazinedione 2,5-Piperazinedione
Find On: PubMed — Wikipedia — Google
CAS Number: 106-57-0
| 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) | -2.34 | -1.77 | -13.12 | 4 | 5 | 0 | 95 | 132.119 | 4 | ↓ |
| Mid Mid (pH 6-8) | -2.34 | -1.39 | -53.07 | 5 | 5 | 1 | 97 | 133.127 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -2.34 | -1 | -109.62 | 6 | 5 | 2 | 99 | 134.135 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | ca 300? dec. | Alfa-Aesar |
| Melting_Point | ca 300° dec. | Alfa-Aesar |
No pre-computed analogs available. Try a structural similarity search.