| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2008 | 31 | 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) | 1.81 | 6.14 | -58.86 | 0 | 7 | -1 | 86 | 440.545 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.81 | 8.48 | -67.73 | 1 | 7 | 0 | 87 | 441.553 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.81 | 7.66 | -49.47 | 2 | 7 | 1 | 84 | 442.561 | 6 | ↓ |
