| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2007 | 31 | 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) | 2.80 | 7.55 | -59.45 | 0 | 7 | -1 | 88 | 442.875 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.24 | 8 | -21.38 | 1 | 7 | 0 | 85 | 443.883 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | -1.04 | -13.64 | 0 | 7 | 0 | 82 | 443.883 | 7 | ↓ |
