| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 21 | 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) | -0.72 | 1.45 | -97.91 | 7 | 5 | 2 | 69 | 293.459 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.72 | 0.07 | -35.34 | 6 | 5 | 1 | 65 | 292.451 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.72 | -1.26 | -1.56 | 5 | 5 | 0 | 60 | 291.443 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.72 | 1.18 | -105.34 | 7 | 5 | 2 | 69 | 293.459 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.72 | 2.55 | -211.17 | 8 | 5 | 3 | 74 | 294.467 | 1 | ↓ |
