| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 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) | -0.44 | 2.91 | -54.78 | 1 | 6 | -1 | 85 | 240.264 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.44 | 0.82 | -33.05 | 3 | 6 | 1 | 84 | 242.28 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.44 | 0.92 | -14.3 | 2 | 6 | 0 | 83 | 241.272 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.44 | 2.8 | -38.64 | 2 | 6 | 0 | 87 | 241.272 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
