| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 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) | 1.13 | 6.04 | -53.37 | 3 | 3 | 1 | 45 | 216.308 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.13 | 5.65 | -8.04 | 2 | 3 | 0 | 44 | 215.3 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.13 | 6.26 | -108.06 | 4 | 3 | 2 | 47 | 217.316 | 4 | ↓ |
