| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 35 | 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) | 4.07 | 8.9 | -58.24 | 0 | 8 | -1 | 101 | 505.553 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.49 | 8.83 | -21.01 | 0 | 8 | 0 | 95 | 506.561 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.52 | 7.85 | -28.66 | 1 | 8 | 0 | 98 | 506.561 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.41 | 8.32 | -37.99 | 1 | 5 | 1 | 43 | 349.426 | 3 | ↓ |
