| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 35 | Yes |
| 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) | 1.86 | 8.63 | -48.68 | 3 | 8 | 1 | 86 | 476.601 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.86 | 6.35 | -16.6 | 2 | 8 | 0 | 85 | 475.593 | 8 | ↓ |
![2-cyclopropyl-3-keto-N-[2-keto-2-[4-(piperazinomethyl)anilino]ethyl]isoindoline-1-carboxamide](http://zinc12.docking.org/img/rings/503338.gif)
