| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2014 | 39 | 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) | 4.13 | 8.74 | -57.62 | 0 | 8 | -1 | 91 | 531.56 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.13 | 11 | -66.07 | 1 | 8 | 0 | 93 | 532.568 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.13 | 7.98 | -13.91 | 1 | 8 | 0 | 89 | 532.568 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.