| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 20 | 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) | 1.52 | 6.4 | -29.82 | 4 | 4 | 1 | 68 | 289.79 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.52 | 7.46 | -3.43 | 3 | 4 | 0 | 66 | 288.782 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.52 | 6.86 | -96.68 | 5 | 4 | 2 | 69 | 290.798 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
