| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2008 | 11 | Yes |
Popular Name: 1-BUTYL-1,4-DIAZEPANE 1-BUTYL-1,4-DIAZEPANE
Find On: PubMed — Wikipedia — Google
CAS Numbers: 3619-75-8 , [3619-75-8]
| 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) | 1.35 | 3.24 | -35.43 | 2 | 2 | 1 | 20 | 157.281 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.35 | 2.02 | -0.76 | 1 | 2 | 0 | 15 | 156.273 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.35 | 3.97 | -32.2 | 2 | 2 | 1 | 16 | 157.281 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 90% | Fluorochem |
