| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 17 | No |
| 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) | 1.44 | 6.51 | -33.46 | 1 | 6 | 0 | 81 | 237.259 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 4.34 | -29.83 | 0 | 6 | -1 | 80 | 236.251 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.44 | 6.95 | -52.9 | 2 | 6 | 1 | 83 | 238.267 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
