| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 33 | 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) | 3.51 | 9.71 | -11.31 | 1 | 7 | 0 | 93 | 511.303 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.51 | 10.63 | -51.85 | 0 | 7 | -1 | 96 | 510.295 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.51 | 10.03 | -37.92 | 2 | 7 | 1 | 94 | 512.311 | 3 | ↓ |
