| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 38 | No |
| 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) | 3.84 | 9.69 | -65.07 | 0 | 9 | -1 | 107 | 524.59 | 13 | ↓ |
| Mid Mid (pH 6-8) | 3.25 | 9.7 | -26.55 | 0 | 9 | 0 | 101 | 525.598 | 13 | ↓ |
| Mid Mid (pH 6-8) | 4.28 | 8.69 | -30.6 | 1 | 9 | 0 | 104 | 525.598 | 12 | ↓ |
| Mid Mid (pH 6-8) | -1.52 | -0.29 | -14.29 | 0 | 8 | 0 | 94 | 315.333 | 2 | ↓ |
