| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2005 | 37 | No |
None
| 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) | 7.89 | 4.41 | -20.41 | 1 | 8 | 0 | 101 | 500.599 | 9 | ↓ |
| Mid Mid (pH 6-8) | 7.89 | 4.59 | -36.92 | 2 | 8 | 1 | 102 | 501.607 | 9 | ↓ |
| Mid Mid (pH 6-8) | 7.89 | 18.22 | -42.12 | 2 | 8 | 1 | 106 | 501.607 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 7.89 | 18.26 | -95.18 | 3 | 8 | 2 | 107 | 502.615 | 9 | ↓ |
