| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 19 | Yes |
Popular Name: (2S)-2-cyclopropyl-2-(ethylamino)-3-isoindolin-2-yl-propanenitrile (2S)-2-cyclopropyl-2-(ethylamino…
| 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) | 2.20 | 8.38 | -41.78 | 2 | 3 | 1 | 40 | 256.373 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.20 | 5.92 | -8.3 | 1 | 3 | 0 | 39 | 255.365 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
