| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 3rd, 2010 | 17 | Yes |
Popular Name: 1-[4-[3-(propylamino)propyl]-1,4-diazepan-1-yl]ethanone 1-[4-[3-(propylamino)propyl]-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) | 0.45 | 7 | -118.29 | 3 | 4 | 2 | 41 | 243.395 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.45 | 5.13 | -47.93 | 2 | 4 | 1 | 40 | 242.387 | 6 | ↓ |
