| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2009 | 28 | 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) | 4.48 | 10.55 | -53.65 | 1 | 6 | -1 | 96 | 387.452 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.48 | 11.33 | -104.76 | 0 | 6 | -2 | 99 | 386.444 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.48 | 8.58 | -14.46 | 2 | 6 | 0 | 93 | 388.46 | 9 | ↓ |
