| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 30th, 2008 | 30 | Yes |
| 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) | 3.21 | 6.06 | -47.47 | 3 | 6 | 1 | 67 | 432.972 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.21 | 7.1 | -46.77 | 3 | 6 | 1 | 64 | 432.972 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.21 | 8.27 | -125.95 | 4 | 6 | 2 | 69 | 433.98 | 8 | ↓ |
