| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2004 | 35 | 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) | 6.13 | 12.33 | -45.97 | 2 | 7 | 1 | 90 | 494.486 | 11 | ↓ |
| Hi High (pH 8-9.5) | 6.13 | 13.07 | -28.81 | 1 | 7 | 0 | 93 | 493.478 | 11 | ↓ |
| Hi High (pH 8-9.5) | 6.13 | 10.26 | -9.58 | 1 | 7 | 0 | 89 | 493.478 | 11 | ↓ |
