| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2010 | 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) | 0.34 | 2.1 | -40.58 | 3 | 4 | 1 | 45 | 225.291 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.34 | 0.75 | -5.07 | 2 | 4 | 0 | 40 | 224.283 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.34 | 2.46 | -83.8 | 4 | 4 | 2 | 46 | 226.299 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
