| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 26th, 2007 | 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) | 4.44 | 9.31 | -65.32 | 1 | 8 | -1 | 112 | 513.551 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.88 | 8.3 | -33.59 | 2 | 8 | 0 | 109 | 514.559 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.86 | -3.06 | -24.09 | 1 | 8 | 0 | 106 | 514.559 | 4 | ↓ |
