| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2012 | 29 | 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) | 1.49 | 7.85 | -47.56 | 4 | 6 | 1 | 82 | 399.49 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.49 | 5.7 | -15 | 3 | 6 | 0 | 81 | 398.482 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.