| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 19th, 2010 | 35 | Yes |
| 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) | 4.52 | 6.86 | -23.23 | 1 | 9 | 0 | 105 | 515.661 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.34 | 5.91 | -50.97 | 0 | 9 | -1 | 111 | 514.653 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.34 | 8.18 | -49.59 | 1 | 9 | 0 | 112 | 515.661 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.52 | 9.01 | -62.83 | 2 | 9 | 1 | 106 | 516.669 | 8 | ↓ |
