| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 36 | 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) | 2.01 | 3.98 | -63.1 | 1 | 9 | -1 | 112 | 499.515 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.46 | 5.09 | -66.09 | 3 | 9 | 1 | 110 | 501.531 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | 6.08 | -68.81 | 2 | 9 | 1 | 107 | 501.531 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 6.31 | -75.99 | 2 | 9 | 0 | 113 | 500.523 | 9 | ↓ |
