| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2009 | 33 | 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) | 5.11 | 14.68 | -58.31 | 1 | 7 | -1 | 82 | 476.607 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.29 | 13.6 | -98.71 | 0 | 7 | -2 | 88 | 475.599 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.38 | 14.84 | -25.15 | 2 | 7 | 0 | 85 | 477.615 | 9 | ↓ |
