| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2009 | 13 | Yes |
Popular Name: 1-Cyclohexyl-[1,4]diazepane 1-Cyclohexyl-[1,4]diazepane
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1609396-64-6 , 59039-67-7
None
| 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) | 1.82 | 4.68 | -27.88 | 2 | 2 | 1 | 16 | 183.319 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.82 | 2.48 | -0.97 | 1 | 2 | 0 | 15 | 182.311 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.82 | 3.74 | -35.15 | 2 | 2 | 1 | 20 | 183.319 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.82 | 5.94 | -108.49 | 3 | 2 | 2 | 21 | 184.327 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 68-72°/0.1mm | Oakwood Chemical |
| Purity | 90% | Fluorochem |
