| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 12th, 2008 | 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) | 3.74 | 10.12 | -60.11 | 0 | 6 | -1 | 83 | 414.437 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.15 | 10.75 | -12.43 | 0 | 6 | 0 | 77 | 415.445 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.74 | 9.3 | -16.05 | 1 | 6 | 0 | 80 | 415.445 | 8 | ↓ |
