| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2009 | 38 | Yes |
None
| 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) | 4.48 | 11.93 | -50.39 | 4 | 8 | 1 | 93 | 515.682 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.48 | 10.93 | -45.86 | 2 | 8 | -1 | 90 | 513.666 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.48 | 10.55 | -13.48 | 3 | 8 | 0 | 87 | 514.674 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.48 | 11.53 | -33.14 | 3 | 8 | 0 | 92 | 514.674 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.48 | 13.05 | -93.57 | 5 | 8 | 2 | 90 | 516.69 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.48 | 13.7 | -91.86 | 4 | 8 | 1 | 93 | 515.682 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.48 | 10.78 | -31.57 | 4 | 8 | 1 | 89 | 515.682 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.48 | 14.2 | -124.29 | 5 | 8 | 2 | 94 | 516.69 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 4.48 | 13.51 | -189.12 | 6 | 8 | 3 | 91 | 517.698 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 4.48 | 11.17 | -95.53 | 5 | 8 | 2 | 90 | 516.69 | 10 | ↓ |
