| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 16th, 2009 | 34 | 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) | 4.74 | 12.65 | -12.1 | 1 | 5 | 0 | 31 | 515.045 | 11 | ↓ |
| Mid Mid (pH 6-8) | 4.74 | 14.91 | -45.35 | 2 | 5 | 1 | 32 | 516.053 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 4.74 | 15.68 | -53.27 | 3 | 5 | 0 | 33 | 517.061 | 11 | ↓ |
