| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 10th, 2011 | 39 | 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) | 4.48 | 11.18 | -51.05 | 4 | 6 | 1 | 92 | 537.675 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.48 | 10.43 | -13.33 | 3 | 6 | 0 | 87 | 536.667 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
