| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 27th, 2006 | 30 | 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) | 3.10 | 7.49 | -62.41 | 1 | 6 | -1 | 94 | 406.389 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.51 | 7.62 | -29.51 | 1 | 6 | 0 | 88 | 407.397 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.54 | 6.62 | -20.35 | 2 | 6 | 0 | 91 | 407.397 | 4 | ↓ |
