| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2008 | 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) | 1.51 | 4.99 | -77.54 | 3 | 7 | 0 | 107 | 410.47 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.51 | 3.51 | -65.98 | 2 | 7 | -1 | 102 | 409.462 | 10 | ↓ |
| Mid Mid (pH 6-8) | 1.95 | 3.97 | -60.43 | 4 | 7 | 1 | 104 | 411.478 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | 5 | -58.4 | 3 | 7 | 1 | 101 | 411.478 | 10 | ↓ |
