| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 3rd, 2010 | 16 | Yes |
Popular Name: 1-[4-[2-(propylamino)ethyl]-1,4-diazepan-1-yl]ethanone 1-[4-[2-(propylamino)ethyl]-1,4-…
| 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) | 0.18 | 4.37 | -48.26 | 2 | 4 | 1 | 40 | 228.36 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.18 | 6.19 | -128.58 | 3 | 4 | 2 | 41 | 229.368 | 5 | ↓ |
