| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 31st, 2007 | 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) | 5.72 | 12.28 | -58.95 | 0 | 7 | -1 | 96 | 487.557 | 8 | ↓ |
| Mid Mid (pH 6-8) | 5.13 | 12.2 | -17.22 | 0 | 7 | 0 | 90 | 488.565 | 8 | ↓ |
| Mid Mid (pH 6-8) | 6.16 | 11.19 | -29.25 | 1 | 7 | 0 | 93 | 488.565 | 7 | ↓ |
