| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2009 | 21 | Yes |
Popular Name: N'-[3-[3-(azepan-1-yl)propylamino]propyl]-N-ethyl-propane-1,3-diamine N'-[3-[3-(azepan-1-yl)propylamin…
| 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) | 1.25 | 8.45 | -276.42 | 7 | 4 | 4 | 54 | 302.551 | 13 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 4.96 | -89.96 | 5 | 4 | 2 | 48 | 300.535 | 13 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 5.54 | -86.21 | 5 | 4 | 2 | 45 | 300.535 | 13 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 6.95 | -163.51 | 6 | 4 | 3 | 50 | 301.543 | 13 | ↓ |
