| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 34 | 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) | 2.04 | 8.16 | -53.23 | 2 | 9 | 1 | 88 | 488.634 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.04 | 5.94 | -22.02 | 1 | 9 | 0 | 87 | 487.626 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.86 | 7.1 | -43.26 | 1 | 9 | 0 | 95 | 487.626 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.04 | 8.16 | -57.95 | 2 | 9 | 1 | 88 | 488.634 | 8 | ↓ |
