| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 35 | Yes |
| 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) | 4.28 | 11.66 | -48.73 | 3 | 7 | 1 | 78 | 511.071 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.28 | 9.29 | -12.69 | 2 | 7 | 0 | 77 | 510.063 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.28 | 12.14 | -92.86 | 4 | 7 | 2 | 79 | 512.079 | 7 | ↓ |
