| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 25th, 2006 | 30 | 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) | 2.35 | 7.24 | -59.76 | 0 | 9 | -1 | 125 | 411.39 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 0.58 | -16.72 | 1 | 9 | 0 | 121 | 412.398 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.77 | 0.47 | -17.36 | 0 | 9 | 0 | 118 | 412.398 | 8 | ↓ |
