| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 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) | 2.82 | 9.65 | -47.24 | 2 | 5 | 1 | 53 | 383.541 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.27 | 7 | -43.16 | 1 | 5 | 0 | 57 | 382.533 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.82 | 7.4 | -10.57 | 1 | 5 | 0 | 52 | 382.533 | 6 | ↓ |
