| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 34 | 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) | 2.45 | 8.45 | -56.55 | 0 | 9 | -1 | 114 | 478.506 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 8.72 | -15.73 | 0 | 9 | 0 | 108 | 479.514 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 7.91 | -18.83 | 1 | 9 | 0 | 111 | 479.514 | 5 | ↓ |
