| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2007 | 32 | 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) | 3.03 | 8.95 | -56.84 | 0 | 9 | -1 | 125 | 439.444 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.47 | 7.92 | -31.78 | 1 | 9 | 0 | 122 | 440.452 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.44 | 0.64 | -27.15 | 0 | 9 | 0 | 118 | 440.452 | 9 | ↓ |
