| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2008 | 29 | 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) | 6.20 | 11.67 | -53.25 | 1 | 6 | -1 | 95 | 494.774 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.71 | 11.55 | -94.1 | 0 | 6 | -2 | 93 | 493.766 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 5.71 | 12.04 | -60.98 | 1 | 6 | -1 | 91 | 494.774 | 7 | ↓ |
