| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2014 | 33 | 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) | 3.50 | 9.77 | -58.41 | 2 | 7 | 1 | 70 | 452.623 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.50 | 12.87 | -105.38 | 3 | 7 | 2 | 71 | 453.631 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.