| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 18th, 2010 | 31 | 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) | 6.63 | 15.64 | -126.71 | 0 | 4 | -2 | 80 | 430.629 | 9 | ↓ |
| Mid Mid (pH 6-8) | 6.63 | 13.82 | -50.14 | 1 | 4 | -1 | 77 | 431.637 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 6.63 | 11.84 | -7.78 | 2 | 4 | 0 | 75 | 432.645 | 9 | ↓ |
