| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2009 | 21 | Yes |
Popular Name: (2S)-2-[(1-oxo-2H-isoquinoline-3-carbonyl)amino]pentanoic (2S)-2-[(1-oxo-2H-isoquinoline-3…
| 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) | 0.36 | 5.61 | -52.44 | 2 | 6 | -1 | 102 | 287.295 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.82 | 3.67 | -112.76 | 1 | 6 | -2 | 105 | 286.287 | 5 | ↓ |
