| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2007 | 31 | 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) | 3.59 | 8.95 | -52.04 | 0 | 7 | -1 | 92 | 500.35 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 9.21 | -12.16 | 0 | 7 | 0 | 86 | 501.358 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.59 | 8.85 | -14.63 | 1 | 7 | 0 | 89 | 501.358 | 6 | ↓ |
