| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 37 | 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) | 5.43 | 11.71 | -16.48 | 2 | 7 | 0 | 88 | 495.579 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.20 | 11.43 | -60.17 | 0 | 7 | -1 | 87 | 494.571 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.20 | 11.69 | -53.15 | 0 | 7 | -1 | 87 | 494.571 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.43 | 12.72 | -45.57 | 1 | 7 | -1 | 91 | 494.571 | 8 | ↓ |
