| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2011 | 12 | 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) | -0.33 | 1.86 | -56.35 | 2 | 4 | 1 | 51 | 171.22 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.33 | -0.06 | -12.92 | 1 | 4 | 0 | 49 | 170.212 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
