| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 20 | Yes |
Popular Name: 4-[4-(2-morpholinoethyl)-1,4-diazepan-1-yl]butan-1-amine 4-[4-(2-morpholinoethyl)-1,4-dia…
| 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) | -0.27 | 1.77 | -98.1 | 4 | 5 | 2 | 48 | 286.464 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.27 | -0.31 | -43.4 | 3 | 5 | 1 | 47 | 285.456 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.27 | 1.74 | -87.84 | 4 | 5 | 2 | 48 | 286.464 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.27 | 4.02 | -159.35 | 5 | 5 | 3 | 49 | 287.472 | 7 | ↓ |
