| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 35 | 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) | 2.18 | 6.83 | -57.29 | 0 | 8 | -1 | 95 | 472.521 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | 9.09 | -72.02 | 1 | 8 | 0 | 96 | 473.529 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.18 | 8.34 | -56.77 | 2 | 8 | 1 | 93 | 474.537 | 7 | ↓ |
