| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 26 | 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) | 0.92 | 3.05 | -21.74 | 3 | 8 | 0 | 123 | 391.43 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 1.62 | -56.09 | 2 | 8 | -1 | 126 | 390.422 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 1.47 | -47.96 | 2 | 8 | -1 | 126 | 390.422 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 1.55 | -48.03 | 2 | 8 | -1 | 126 | 390.422 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.14 | 1.39 | -86.94 | 1 | 8 | -2 | 129 | 389.414 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 1.7 | -56.13 | 2 | 8 | -1 | 126 | 390.422 | 3 | ↓ |
