| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2010 | 16 | Yes |
Popular Name: 1-(4,6-dimethylpyrimidin-2-yl)-4-methyl-1,4-diazepane 1-(4,6-dimethylpyrimidin-2-yl)-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) | 1.80 | 9.34 | -36.33 | 1 | 4 | 1 | 33 | 221.328 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 7.34 | -6.58 | 0 | 4 | 0 | 32 | 220.32 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.80 | 9.6 | -85.81 | 2 | 4 | 2 | 35 | 222.336 | 1 | ↓ |
