| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 35 | 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) | 4.56 | 12.76 | -65.52 | 1 | 7 | 0 | 87 | 476.573 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.56 | 10.23 | -58.85 | 0 | 7 | -1 | 86 | 475.565 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 4.56 | 11.64 | -43.79 | 2 | 7 | 1 | 84 | 477.581 | 10 | ↓ |
