| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 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 | 7.55 | -56.85 | 0 | 6 | -1 | 73 | 445.948 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | -1.57 | -46.07 | 2 | 6 | 1 | 71 | 447.964 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | -1.84 | -47.53 | 1 | 6 | 1 | 68 | 447.964 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 9.88 | -75.24 | 1 | 6 | 0 | 74 | 446.956 | 7 | ↓ |
