| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 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) | 3.97 | 11.91 | -45.24 | 0 | 8 | -1 | 101 | 513.57 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.39 | -1.25 | -22.58 | 0 | 8 | 0 | 95 | 514.578 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 3.97 | 11.22 | -53.28 | 2 | 8 | 1 | 99 | 515.586 | 10 | ↓ |
