| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 20 | Yes |
Popular Name: (2R)-2-cyclopropyl-2-(ethylamino)-3-[(2S)-2-methylindolin-1-yl]propanenitrile (2R)-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) | 3.24 | 8.03 | -4.74 | 1 | 3 | 0 | 39 | 269.392 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.24 | 9.43 | -35.84 | 2 | 3 | 1 | 40 | 270.4 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.24 | 9.01 | -34.7 | 2 | 3 | 1 | 44 | 270.4 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
