| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2007 | 36 | 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) | 7.20 | 14.96 | -53.95 | 0 | 5 | -1 | 73 | 499.587 | 6 | ↓ |
| Mid Mid (pH 6-8) | 6.62 | 14.94 | -14.67 | 0 | 5 | 0 | 67 | 500.595 | 6 | ↓ |
| Mid Mid (pH 6-8) | 7.65 | 13.94 | -26.09 | 1 | 5 | 0 | 71 | 500.595 | 5 | ↓ |
