| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2010 | 21 | Yes |
Popular Name: (2R)-2-[methyl-(1-oxo-2H-isoquinoline-3-carbonyl)amino]butanoic (2R)-2-[methyl-(1-oxo-2H-isoquin…
| 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) | 0.05 | 6.1 | -46.75 | 1 | 6 | -1 | 93 | 287.295 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.51 | 5.54 | -110.19 | 0 | 6 | -2 | 96 | 286.287 | 4 | ↓ |
