| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 35 | No |
None
| 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) | 2.57 | 8.45 | -18.05 | 1 | 8 | 0 | 98 | 474.513 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.98 | 9.1 | -25.97 | 0 | 8 | 0 | 95 | 474.513 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.01 | 8.41 | -64.29 | 2 | 8 | 1 | 99 | 475.521 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.98 | 9.38 | -67.84 | 1 | 8 | 1 | 96 | 475.521 | 9 | ↓ |
