| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2007 | 32 | 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) | 2.45 | 5.76 | -59.22 | 0 | 8 | -1 | 95 | 439.488 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 8.47 | -47.51 | 2 | 8 | 1 | 94 | 441.504 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | -0.76 | -48.57 | 1 | 8 | 1 | 90 | 441.504 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.45 | 8.1 | -71.08 | 1 | 8 | 0 | 96 | 440.496 | 9 | ↓ |
