| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 36 | 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) | 4.22 | 8.85 | -54.67 | 0 | 7 | -1 | 86 | 523.034 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.22 | 11.65 | -74.56 | 1 | 7 | 0 | 87 | 524.042 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.22 | 10.83 | -57.29 | 2 | 7 | 1 | 84 | 525.05 | 7 | ↓ |
