| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 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) | 2.62 | 9.07 | -77.33 | 1 | 7 | 0 | 83 | 430.526 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 7.71 | -57.49 | 2 | 7 | 1 | 81 | 431.534 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.04 | 8.9 | -59.03 | 1 | 7 | 1 | 77 | 431.534 | 9 | ↓ |
