| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 25th, 2008 | 28 | No |
| 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) | 2.00 | 10.09 | -78.54 | 1 | 6 | 0 | 78 | 379.46 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.00 | 7.56 | -62.08 | 0 | 6 | -1 | 77 | 378.452 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.00 | 9.13 | -53.47 | 2 | 6 | 1 | 75 | 380.468 | 6 | ↓ |
