| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 13 | 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) | 0.17 | 2.37 | -10.02 | 1 | 4 | 0 | 49 | 179.223 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.17 | 2.01 | -28.14 | 2 | 4 | 1 | 50 | 180.231 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.17 | 2.54 | -33.49 | 2 | 4 | 1 | 50 | 180.231 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
