| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2006 | 30 | 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) | 2.26 | 7.12 | -62.5 | 0 | 7 | -1 | 92 | 409.462 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | -0.68 | -17.38 | 1 | 7 | 0 | 88 | 410.47 | 10 | ↓ |
| Mid Mid (pH 6-8) | 1.67 | -0.81 | -27.65 | 0 | 7 | 0 | 85 | 410.47 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 2.25 | -0.57 | -48.06 | 2 | 7 | 1 | 90 | 411.478 | 10 | ↓ |
