| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 22nd, 2008 | 16 | 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) | 3.75 | 5.8 | -7.31 | 1 | 2 | 0 | 26 | 232.352 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.75 | 5.04 | -41.97 | 0 | 2 | -1 | 25 | 231.344 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.75 | 6.7 | -30.73 | 2 | 2 | 1 | 28 | 233.36 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.