| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2006 | 29 | 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) | 2.72 | 6.19 | -58.84 | 1 | 6 | -1 | 94 | 392.362 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.72 | 0.1 | -13.19 | 2 | 6 | 0 | 90 | 393.37 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | -0.02 | -12.18 | 1 | 6 | 0 | 87 | 393.37 | 5 | ↓ |
