| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 32 | Yes |
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) | 3.66 | 8.7 | -48.89 | 1 | 7 | 1 | 66 | 437.516 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.66 | 5.86 | -13.52 | 0 | 7 | 0 | 64 | 436.508 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.66 | 8.13 | -48.57 | 1 | 7 | 1 | 66 | 437.516 | 5 | ↓ |
