| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 6th, 2008 | 22 | No |
Popular Name: (3S)-3-heptyl-8-hydroxy-6-oxo-3,4-dihydroisochromene-7-carboxylic (3S)-3-heptyl-8-hydroxy-6-oxo-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) | 3.86 | 10.25 | -154.12 | 0 | 5 | -2 | 89 | 304.342 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.07 | 8.51 | -70.21 | 1 | 5 | -1 | 87 | 305.35 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.26 | 9.32 | -69.81 | 0 | 5 | -1 | 84 | 305.35 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.86 | 8.26 | -52.51 | 1 | 5 | -1 | 87 | 305.35 | 7 | ↓ |
