| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 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) | 0.59 | 2.31 | -57.95 | 3 | 5 | 1 | 71 | 218.284 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.59 | 2.05 | -11.67 | 2 | 5 | 0 | 70 | 217.276 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.59 | 2.77 | -99.65 | 4 | 5 | 2 | 72 | 219.292 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
