| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 26th, 2009 | 22 | 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) | 1.97 | 2.3 | -51.24 | 1 | 6 | -1 | 96 | 323.708 | 1 | ↓ |
| Ref Reference (pH 7) | 1.97 | 2.25 | -51.95 | 1 | 6 | -1 | 96 | 323.708 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.97 | 3.08 | -92.86 | 0 | 6 | -2 | 99 | 322.7 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.97 | 3.03 | -97.26 | 0 | 6 | -2 | 99 | 322.7 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.22 | 2.58 | -14.32 | 1 | 6 | 0 | 90 | 324.716 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.97 | 0.55 | -17.52 | 2 | 6 | 0 | 93 | 324.716 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.97 | 0.59 | -13.15 | 2 | 6 | 0 | 93 | 324.716 | 1 | ↓ |
