| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 12th, 2010 | 18 | Yes |
Popular Name: 2-[4-(6-ethylpyrimidin-4-yl)-1,4-diazepan-1-yl]ethanamine 2-[4-(6-ethylpyrimidin-4-yl)-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) | 0.22 | 4.83 | -48.83 | 3 | 5 | 1 | 60 | 250.37 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.22 | 5.21 | -82.93 | 4 | 5 | 2 | 61 | 251.378 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.22 | 6.99 | -183.05 | 5 | 5 | 3 | 62 | 252.386 | 4 | ↓ |
