| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 37 | 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) | 7.29 | 15.02 | -12.05 | 2 | 7 | 0 | 81 | 506.532 | 7 | ↓ |
| Hi High (pH 8-9.5) | 7.29 | 14.64 | -47.05 | 1 | 7 | -1 | 79 | 505.524 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 7.29 | 15.89 | -87.52 | 4 | 7 | 2 | 83 | 508.548 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 7.29 | 15.33 | -36.17 | 3 | 7 | 1 | 82 | 507.54 | 7 | ↓ |
