| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 37 | 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) | 4.38 | 9.56 | -58.57 | 0 | 7 | -1 | 82 | 509.598 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.83 | 10.79 | -60.2 | 2 | 7 | 1 | 81 | 511.614 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.80 | 11.76 | -60.04 | 1 | 7 | 1 | 77 | 511.614 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.38 | 11.89 | -72.67 | 1 | 7 | 0 | 83 | 510.606 | 9 | ↓ |
