| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 16th, 2008 | 16 | 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) | 1.67 | 4.16 | -40.55 | 2 | 3 | 1 | 28 | 223.34 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 3.86 | -36.99 | 2 | 3 | 1 | 28 | 223.34 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 4.64 | -57.56 | 1 | 3 | 0 | 31 | 222.332 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.67 | 6.18 | -108.76 | 3 | 3 | 2 | 29 | 224.348 | 6 | ↓ |
