| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2009 | 38 | 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) | 3.50 | 8.33 | -17.56 | 3 | 9 | 0 | 111 | 514.582 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.69 | 7.42 | -53.43 | 2 | 9 | -1 | 118 | 513.574 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.50 | 9.55 | -58.92 | 2 | 9 | -1 | 114 | 513.574 | 7 | ↓ |
