| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2007 | 36 | 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) | 5.03 | 10.36 | -55.38 | 1 | 7 | -1 | 103 | 503.531 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.44 | 10.5 | -12.91 | 1 | 7 | 0 | 97 | 504.539 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.47 | 9.09 | -18.98 | 2 | 7 | 0 | 100 | 504.539 | 5 | ↓ |
