| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 27 | Yes |
| 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) | -0.80 | 2.45 | -79.52 | 5 | 7 | 1 | 111 | 375.445 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.80 | -0.21 | -59.16 | 3 | 7 | -1 | 105 | 373.429 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.80 | 1.45 | -88.2 | 4 | 7 | 0 | 106 | 374.437 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.80 | 0.78 | -37.89 | 4 | 7 | 0 | 110 | 374.437 | 3 | ↓ |
