| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 13th, 2009 | 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) | 1.13 | 6.04 | -48.92 | 0 | 7 | -1 | 86 | 410.425 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.13 | 8.37 | -68.44 | 1 | 7 | 0 | 87 | 411.433 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.13 | 7.08 | -63.03 | 2 | 7 | 1 | 84 | 412.441 | 6 | ↓ |
