| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 35 | 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) | 4.86 | 11.56 | -62.38 | 0 | 6 | -1 | 73 | 475.609 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.86 | 13.83 | -78.39 | 1 | 6 | 0 | 74 | 476.617 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.86 | 12.94 | -49.98 | 2 | 6 | 1 | 71 | 477.625 | 8 | ↓ |
