| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 8th, 2006 | 35 | 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) | 2.86 | 10.62 | -14.98 | 2 | 10 | 0 | 116 | 469.505 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.04 | 10 | -44.74 | 1 | 10 | -1 | 122 | 468.497 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.03 | 10.94 | -44.3 | 3 | 10 | 1 | 121 | 470.513 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.86 | 10.9 | -48.57 | 3 | 10 | 1 | 117 | 470.513 | 7 | ↓ |
