| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 26th, 2007 | 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) | 4.79 | 11.27 | -54.96 | 0 | 7 | -1 | 92 | 503.943 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.21 | 11.3 | -22.65 | 0 | 7 | 0 | 86 | 504.951 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.24 | 10.31 | -31.25 | 1 | 7 | 0 | 89 | 504.951 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.15 | 8 | -40.83 | 2 | 4 | 1 | 43 | 349.52 | 5 | ↓ |
