| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 17 | Yes |
Popular Name: 2-[4-(2-aminoacetyl)-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide 2-[4-(2-aminoacetyl)-1,4-diazepa…
| 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) | -2.46 | 2.42 | -103.88 | 4 | 6 | 2 | 73 | 244.339 | 3 | ↓ |
| Hi High (pH 8-9.5) | -2.46 | 0.31 | -15.38 | 2 | 6 | 0 | 70 | 242.323 | 3 | ↓ |
| Hi High (pH 8-9.5) | -2.46 | 0.71 | -54.04 | 3 | 6 | 1 | 71 | 243.331 | 3 | ↓ |
| Mid Mid (pH 6-8) | -2.46 | 2.02 | -43.78 | 3 | 6 | 1 | 71 | 243.331 | 3 | ↓ |
