| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 7th, 2008 | 35 | 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) | 4.22 | 12.26 | -76.86 | 1 | 7 | 0 | 91 | 493.629 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.67 | 11.11 | -58.69 | 2 | 7 | 1 | 88 | 494.637 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.64 | 12.15 | -57.43 | 1 | 7 | 1 | 85 | 494.637 | 10 | ↓ |
