| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2010 | 15 | Yes |
None
| 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) | -0.32 | 5.09 | -35.33 | 1 | 4 | 1 | 39 | 208.285 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.32 | 4.62 | -10.63 | 0 | 4 | 0 | 38 | 207.277 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.32 | 6.83 | -57.67 | 1 | 4 | 1 | 39 | 208.285 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.32 | 7.3 | -108.32 | 2 | 4 | 2 | 41 | 209.293 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
