| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2008 | 26 | 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) | 4.85 | 7.86 | -46.68 | 1 | 7 | -1 | 110 | 388.812 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.34 | 8.43 | -40.05 | 1 | 7 | -1 | 114 | 388.812 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.85 | 8.86 | -90.49 | 0 | 7 | -2 | 113 | 387.804 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.85 | 8.4 | -15.26 | 2 | 7 | 0 | 108 | 389.82 | 4 | ↓ |
