| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2007 | 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) | 1.37 | 3.41 | -68.68 | 1 | 8 | -1 | 108 | 410.402 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.78 | -2.89 | -12.93 | 1 | 8 | 0 | 102 | 411.41 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.37 | 2.59 | -23.15 | 2 | 8 | 0 | 106 | 411.41 | 6 | ↓ |
