| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 12th, 2009 | 37 | 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) | 3.19 | 9.15 | -64.05 | 0 | 9 | -1 | 105 | 511.595 | 12 | ↓ |
| Mid Mid (pH 6-8) | 3.19 | 11.49 | -82.29 | 1 | 9 | 0 | 106 | 512.603 | 12 | ↓ |
| Lo Low (pH 4.5-6) | 3.19 | 10.54 | -60.54 | 2 | 9 | 1 | 103 | 513.611 | 12 | ↓ |
