| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 27 | 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) | 2.29 | 2.18 | -15.14 | 3 | 7 | 0 | 108 | 409.464 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.29 | 2.24 | -40.83 | 2 | 7 | -1 | 110 | 408.456 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.22 | 2.34 | -14.62 | 3 | 7 | 0 | 112 | 409.464 | 5 | ↓ |
