| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 14 | 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) | -0.38 | 2.83 | -40.57 | 2 | 4 | 1 | 46 | 193.274 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.38 | 3.18 | -34.76 | 2 | 4 | 1 | 42 | 193.274 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.38 | 1.11 | -5.48 | 1 | 4 | 0 | 41 | 192.266 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
