| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 21 | 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) | 3.36 | 8.73 | -38.18 | 2 | 5 | 1 | 72 | 280.307 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.36 | 8.3 | -12.77 | 1 | 5 | 0 | 71 | 279.299 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
