| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 16 | 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) | 2.14 | 5.84 | -12.35 | 1 | 3 | 0 | 42 | 229.308 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 5.61 | -11.24 | 2 | 3 | 0 | 44 | 229.308 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.14 | 6.34 | -29.77 | 2 | 3 | 1 | 43 | 230.316 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 3.00 | 6.12 | -22.17 | 3 | 3 | 1 | 45 | 230.316 | 1 | ↓ |
