| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2011 | 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) | 1.49 | 5.25 | -42.03 | 3 | 8 | 1 | 98 | 376.433 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.49 | 3.11 | -14.57 | 2 | 8 | 0 | 97 | 375.425 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.30 | 2.43 | -54.97 | 1 | 8 | -1 | 103 | 374.417 | 6 | ↓ |
