| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2009 | 34 | 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) | 1.94 | 7.09 | -52.72 | 0 | 8 | -1 | 95 | 462.526 | 10 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 9.49 | -70.78 | 1 | 8 | 0 | 96 | 463.534 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 1.94 | 8.2 | -57.25 | 2 | 8 | 1 | 93 | 464.542 | 10 | ↓ |
