| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 23 | Yes |
Popular Name: 2-[4-[2-(tert-butylamino)-2-oxo-ethyl]-1,4-diazepan-1-yl]-N,N-diethyl-acetamide 2-[4-[2-(tert-butylamino)-2-oxo-…
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| 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) | 1.40 | 5.78 | -42.34 | 2 | 6 | 1 | 57 | 327.493 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.40 | 3.77 | -14.38 | 1 | 6 | 0 | 56 | 326.485 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.40 | 5.78 | -41 | 2 | 6 | 1 | 57 | 327.493 | 7 | ↓ |
