| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 21 | Yes |
Popular Name: (2S)-2-cyclopropyl-3-isoindolin-2-yl-2-(isopropylamino)propanoic (2S)-2-cyclopropyl-3-isoindolin-…
| 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) | -0.02 | 9.17 | -65.5 | 3 | 4 | 1 | 61 | 289.399 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.02 | 9.34 | -31.77 | 2 | 4 | 0 | 57 | 288.391 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.02 | 7.37 | -36.21 | 2 | 4 | 0 | 60 | 288.391 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
