| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2011 | 22 | Yes |
Popular Name: (2S)-2-[4-[(2S)-2-amino-3-hydroxy-3-oxo-propyl]triazol-1-yl]-3-phenyl-propanoic (2S)-2-[4-[(2S)-2-amino-3-hydrox…
None
| 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) | -2.04 | 5.37 | -62.85 | 3 | 8 | -1 | 139 | 303.298 | 7 | ↓ |
| Hi High (pH 8-9.5) | -2.04 | 4.85 | -92.99 | 2 | 8 | -2 | 137 | 302.29 | 7 | ↓ |
| Lo Low (pH 4.5-6) | -2.04 | 3.27 | -39.39 | 4 | 8 | 0 | 136 | 304.306 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
