| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 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) | 4.13 | 10.51 | -45.82 | 1 | 8 | -1 | 112 | 515.586 | 11 | ↓ |
| Mid Mid (pH 6-8) | 4.57 | 9.1 | -15.49 | 2 | 8 | 0 | 109 | 516.594 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 4.13 | 10.64 | -44.11 | 3 | 8 | 1 | 110 | 517.602 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 3.54 | 10.95 | -45.88 | 2 | 8 | 1 | 107 | 517.602 | 11 | ↓ |
