| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2004 | 32 | 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) | 1.43 | 3.99 | -55.1 | 5 | 13 | 1 | 171 | 442.46 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.43 | 1.73 | -20.95 | 4 | 13 | 0 | 170 | 441.452 | 7 | ↓ |
