| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 37 | 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) | 4.39 | 9.9 | -57.46 | 0 | 7 | -1 | 82 | 520.005 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.39 | 12.17 | -75.41 | 1 | 7 | 0 | 83 | 521.013 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.39 | 11.41 | -54.29 | 2 | 7 | 1 | 81 | 522.021 | 8 | ↓ |
