| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 15th, 2010 | 24 | 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) | 2.50 | 5.2 | -18.59 | 1 | 5 | 0 | 80 | 364.423 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.96 | 2.95 | -53.79 | 0 | 5 | -1 | 83 | 363.415 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
