| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 12 | 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) | -0.47 | -0.98 | -32.01 | 4 | 4 | 1 | 60 | 172.252 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.71 | -2.51 | -28.31 | 3 | 4 | 0 | 63 | 171.244 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.47 | 0.27 | -108.73 | 5 | 4 | 2 | 64 | 173.26 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.47 | -1.96 | -36.39 | 4 | 4 | 1 | 63 | 172.252 | 2 | ↓ |
