| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2011 | 21 | Yes |
Popular Name: (2S)-2-amino-2-cyclopropyl-3-[(2-methyl-8-quinolyl)oxy]propanoic (2S)-2-amino-2-cyclopropyl-3-[(2…
| 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) | -0.39 | 6.29 | -43.63 | 3 | 5 | 0 | 90 | 286.331 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.39 | 6.05 | -62.76 | 2 | 5 | -1 | 88 | 285.323 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.39 | 6.73 | -60.51 | 4 | 5 | 1 | 91 | 287.339 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
