| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 33 | 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) | 4.62 | 9.41 | -57.59 | 0 | 7 | -1 | 92 | 477.543 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.62 | 9.09 | -15.18 | 1 | 7 | 0 | 89 | 478.551 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.04 | -1.61 | -12.2 | 0 | 7 | 0 | 85 | 478.551 | 6 | ↓ |
