| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2011 | 17 | 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) | 2.38 | 6.14 | -45.2 | 2 | 5 | 1 | 72 | 257.697 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.38 | 4.78 | -4.85 | 1 | 5 | 0 | 67 | 256.689 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
