| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 31st, 2010 | 25 | Yes |
Popular Name: 2-[4-[2-(tert-butylamino)-2-oxo-ethyl]-1,4-diazepan-1-yl]-N,N-diisopropyl-acetamide 2-[4-[2-(tert-butylamino)-2-oxo-…
| 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) | 1.99 | 6.47 | -39.08 | 2 | 6 | 1 | 57 | 355.547 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 6.34 | -42.31 | 2 | 6 | 1 | 57 | 355.547 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.99 | 8.31 | -116.89 | 3 | 6 | 2 | 58 | 356.555 | 7 | ↓ |
