| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2007 | 33 | 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) | 3.38 | 9.85 | -54.1 | 0 | 6 | -1 | 83 | 443.454 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 0.84 | -13.73 | 0 | 6 | 0 | 76 | 444.462 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.80 | 0.95 | -43.76 | 1 | 6 | 1 | 77 | 445.47 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.38 | 9.03 | -14.38 | 1 | 6 | 0 | 80 | 444.462 | 8 | ↓ |
