| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 15 | 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) | 0.08 | 1.8 | -87.33 | 6 | 4 | 2 | 77 | 209.293 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.08 | -0.42 | -4.78 | 4 | 4 | 0 | 71 | 207.277 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.08 | 1.33 | -40.95 | 5 | 4 | 1 | 76 | 208.285 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
