| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 12th, 2007 | 38 | 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) | 4.37 | 15.15 | -70.27 | 1 | 9 | 0 | 120 | 515.566 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.37 | 12.62 | -51.85 | 0 | 9 | -1 | 119 | 514.558 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.79 | 1.73 | -58.15 | 1 | 9 | 1 | 113 | 516.574 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.37 | 14.03 | -55.95 | 2 | 9 | 1 | 117 | 516.574 | 10 | ↓ |
