| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2009 | 36 | 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) | -2.04 | 1.96 | -92.9 | 6 | 14 | 0 | 211 | 534.58 | 6 | ↓ |
| Hi High (pH 8-9.5) | -2.04 | 2.56 | -138.49 | 5 | 14 | -1 | 214 | 533.572 | 6 | ↓ |
| Hi High (pH 8-9.5) | -2.04 | 1.54 | -126.69 | 4 | 14 | -2 | 209 | 532.564 | 6 | ↓ |
| Mid Mid (pH 6-8) | -2.34 | 3.15 | -126.6 | 5 | 14 | -1 | 214 | 533.572 | 7 | ↓ |
| Lo Low (pH 4.5-6) | -1.50 | 4.01 | -117.56 | 7 | 14 | 1 | 212 | 535.588 | 6 | ↓ |
