| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 15th, 2008 | 25 | 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) | 5.42 | 8.48 | -43.34 | 0 | 3 | -1 | 45 | 457.753 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.96 | 9.57 | -9.46 | 1 | 3 | 0 | 42 | 458.761 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
