| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2009 | 27 | 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) | 1.80 | 9.38 | -68.24 | 1 | 6 | 0 | 78 | 385.851 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 6.84 | -48.44 | 0 | 6 | -1 | 77 | 384.843 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.80 | 8.09 | -59.4 | 2 | 6 | 1 | 75 | 386.859 | 6 | ↓ |
