| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 35 | 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) | 2.58 | 7.57 | -56.75 | 1 | 8 | -1 | 112 | 471.489 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.00 | -1.98 | -24.72 | 1 | 8 | 0 | 106 | 472.497 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.58 | -1.71 | -44.04 | 3 | 8 | 1 | 110 | 473.505 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.00 | -1.86 | -53.37 | 2 | 8 | 1 | 107 | 473.505 | 9 | ↓ |
