| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 30th, 2009 | 34 | 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) | -2.60 | -1.56 | -83.72 | 9 | 14 | 0 | 225 | 497.534 | 11 | ↓ |
| Hi High (pH 8-9.5) | -1.88 | -1.97 | -116.2 | 8 | 14 | -1 | 222 | 496.526 | 11 | ↓ |
| Hi High (pH 8-9.5) | -2.60 | -1.9 | -68.16 | 8 | 14 | -1 | 224 | 496.526 | 11 | ↓ |
| Hi High (pH 8-9.5) | -1.88 | -2.28 | -113.68 | 7 | 14 | -2 | 221 | 495.518 | 11 | ↓ |
