| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 26th, 2007 | 33 | 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) | 3.17 | 10.94 | -59.39 | 0 | 7 | -1 | 92 | 444.463 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.59 | -0.16 | -24.68 | 0 | 7 | 0 | 86 | 445.471 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.62 | -0.45 | -29.03 | 1 | 7 | 0 | 89 | 445.471 | 5 | ↓ |
