| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 23 | 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) | 4.44 | 6.81 | -8.45 | 2 | 3 | 0 | 45 | 300.361 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.44 | 7.56 | -45.06 | 1 | 3 | -1 | 48 | 299.353 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.44 | 7.24 | -31.71 | 3 | 3 | 1 | 46 | 301.369 | 3 | ↓ |
