| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2009 | 29 | 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 | 8.81 | -7.43 | 1 | 5 | 0 | 43 | 418.965 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.37 | 11.46 | -39.3 | 2 | 5 | 1 | 44 | 419.973 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 4.37 | 11.33 | -134.37 | 3 | 5 | 2 | 49 | 420.981 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 4.37 | 8.86 | -54.69 | 2 | 5 | 1 | 48 | 419.973 | 10 | ↓ |
