| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 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) | 3.36 | 8.2 | -56.35 | 0 | 8 | -1 | 90 | 514.389 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 10.46 | -66.77 | 1 | 8 | 0 | 91 | 515.397 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.36 | 9.7 | -53.06 | 2 | 8 | 1 | 89 | 516.405 | 6 | ↓ |
