| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 26th, 2009 | 30 | 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) | 3.76 | 9.18 | -55.18 | 3 | 7 | 1 | 96 | 427.55 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.76 | 7.19 | -19.75 | 2 | 7 | 0 | 94 | 426.542 | 8 | ↓ |
