| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 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) | 0.11 | -1.23 | -40.44 | 4 | 4 | 1 | 63 | 198.29 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.11 | -2.91 | -7.71 | 3 | 4 | 0 | 58 | 197.282 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.11 | -0.78 | -37.07 | 4 | 4 | 1 | 60 | 198.29 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
