| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2010 | 20 | Yes |
Popular Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-2-(m-tolyl)ethanone 1-[4-(2-aminoethyl)-1,4-diazepan…
| 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) | 0.86 | 7.22 | -126.53 | 4 | 4 | 2 | 52 | 277.412 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 6.83 | -41.77 | 3 | 4 | 1 | 51 | 276.404 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 5.43 | -51.14 | 3 | 4 | 1 | 51 | 276.404 | 4 | ↓ |
