| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2006 | 29 | 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) | 3.55 | 8.92 | -61.35 | 0 | 6 | -1 | 83 | 396.463 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.99 | 2 | -14.52 | 1 | 6 | 0 | 79 | 397.471 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.96 | 1.82 | -13.08 | 0 | 6 | 0 | 76 | 397.471 | 7 | ↓ |
