| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2011 | 34 | 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) | 3.81 | 12.1 | -10.53 | 1 | 5 | 0 | 89 | 462.586 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.81 | 12.57 | -56.44 | 0 | 5 | -1 | 91 | 461.578 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
