| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2007 | 38 | 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) | 4.00 | 9.58 | -58.94 | 0 | 8 | -1 | 91 | 519.618 | 12 | ↓ |
| Mid Mid (pH 6-8) | 4.44 | 11.87 | -47.41 | 2 | 8 | 1 | 90 | 521.634 | 11 | ↓ |
| Mid Mid (pH 6-8) | 4.00 | 11.91 | -75.18 | 1 | 8 | 0 | 93 | 520.626 | 12 | ↓ |
