| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 27th, 2010 | 21 | No |
Popular Name: 2-[2-(1,4-diazepan-1-yl)-2-oxoethyl]-1H-isoindole-1,3(2H)-dione 2-[2-(1,4-diazepan-1-yl)-2-oxoet…
| 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) | 0.44 | 5.5 | -50.66 | 2 | 6 | 1 | 76 | 288.327 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.44 | 4.15 | -16.31 | 1 | 6 | 0 | 71 | 287.319 | 2 | ↓ |
