| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2006 | 17 | No |
Popular Name: Cyclobarbital Cyclobarbital
143-76-0; Cyclobarbital calcium (BAN); D07757; Phanodorn calcium (TN)
5-(cyclohexen-1-yl)-5-ethyl-1,3-diazinane-2,4,6-trione
52-31-3; Ciclobarbital (TN); Cyclobarbital (INN); D07323
| 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) | 1.97 | 1.68 | -7.27 | 2 | 5 | 0 | 75 | 236.271 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | -0.08 | -38.4 | 1 | 5 | -1 | 82 | 235.263 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.27 | -0.07 | -38.43 | 1 | 5 | -1 | 82 | 235.263 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Molecular_Solubility | 2.585 | Bitter DB |
