| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2009 | 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) | 2.56 | 5.73 | -61.49 | 1 | 7 | -1 | 93 | 453.49 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.56 | 8.06 | -84.52 | 2 | 7 | 0 | 94 | 454.498 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.56 | 7.23 | -64.46 | 3 | 7 | 1 | 92 | 455.506 | 7 | ↓ |
