| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 21 | Yes |
Popular Name: (2S)-2-cyclopropyl-2-(ethylamino)-3-[(2S)-2-methylindolin-1-yl]propanoic (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) | 0.72 | 9.54 | -30.83 | 2 | 4 | 0 | 60 | 288.391 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.72 | 8.54 | -47.67 | 1 | 4 | -1 | 55 | 287.383 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.72 | 9.37 | -45.85 | 3 | 4 | 1 | 61 | 289.399 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
