| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 16 | 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) | 1.40 | 6.78 | -97.92 | 4 | 2 | 2 | 32 | 218.344 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.40 | 6.37 | -34.87 | 3 | 2 | 1 | 30 | 217.336 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 4.52 | -41.81 | 3 | 2 | 1 | 31 | 217.336 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
