| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 4th, 2014 | 35 | Yes |
| 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) | 5.52 | 14.48 | -45.17 | 2 | 4 | 1 | 37 | 476.591 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.52 | 12.22 | -9.72 | 1 | 4 | 0 | 36 | 475.583 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.