| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2008 | 32 | 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) | 2.08 | 6.94 | -60.21 | 0 | 7 | -1 | 86 | 454.572 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.08 | 9.28 | -73.63 | 1 | 7 | 0 | 87 | 455.58 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.08 | 8.46 | -49.31 | 2 | 7 | 1 | 84 | 456.588 | 7 | ↓ |
