| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 9th, 2004 | 28 | No |
None
| 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) | 2.97 | 6.04 | -12.02 | 3 | 7 | 0 | 103 | 437.308 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.97 | 5.9 | -50.56 | 2 | 7 | -1 | 106 | 436.3 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.50 | 4.98 | -43.51 | 2 | 7 | -1 | 105 | 436.3 | 6 | ↓ |
