| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2009 | 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) | 6.79 | 12.43 | -55.58 | 1 | 3 | -1 | 60 | 455.703 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 6.79 | 10.57 | -6.04 | 2 | 3 | 0 | 58 | 456.711 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.