| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 25th, 2009 | 20 | Yes |
Popular Name: (2R)-3-hydroxy-2-[(1-oxo-2H-isoquinoline-3-carbonyl)amino]propanoic (2R)-3-hydroxy-2-[(1-oxo-2H-isoq…
| 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) | -1.71 | 0.66 | -56.24 | 3 | 7 | -1 | 122 | 275.24 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.25 | -1.33 | -117.22 | 2 | 7 | -2 | 125 | 274.232 | 4 | ↓ |
