| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 12 | 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) | -3.02 | -1.87 | -47.28 | 2 | 6 | -1 | 98 | 171.132 | 3 | ↓ |
| Hi High (pH 8-9.5) | -3.02 | -0.62 | -44.99 | 3 | 6 | 0 | 103 | 172.14 | 3 | ↓ |
| Mid Mid (pH 6-8) | -2.84 | -3.09 | -55.93 | 2 | 6 | -1 | 109 | 171.132 | 3 | ↓ |
| Mid Mid (pH 6-8) | -2.84 | -3.09 | -55.92 | 2 | 6 | -1 | 109 | 171.132 | 3 | ↓ |
