| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 31 | 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) | 1.92 | 6.01 | -58.63 | 1 | 7 | -1 | 89 | 422.505 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.92 | 8.27 | -65.59 | 2 | 7 | 0 | 90 | 423.513 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.92 | 7.51 | -48.11 | 3 | 7 | 1 | 87 | 424.521 | 6 | ↓ |
