| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2011 | 21 | 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) | 1.09 | 3.73 | -23.62 | 3 | 5 | 1 | 59 | 301.451 | 12 | ↓ |
| Hi High (pH 8-9.5) | 1.09 | 2.22 | -2.34 | 2 | 5 | 0 | 54 | 300.443 | 12 | ↓ |
| Lo Low (pH 4.5-6) | 1.09 | 3.95 | -88.37 | 4 | 5 | 2 | 60 | 302.459 | 12 | ↓ |
