| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2008 | 23 | 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) | 1.66 | 6.99 | -13.87 | 3 | 6 | 0 | 76 | 327.413 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.66 | 6.8 | -56.47 | 4 | 6 | 1 | 78 | 328.421 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.66 | 9.25 | -98.71 | 5 | 6 | 2 | 79 | 329.429 | 2 | ↓ |
