| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2011 | 12 | 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) | 1.01 | 0.83 | -3.13 | 4 | 3 | 0 | 50 | 163.224 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.01 | 1.39 | -38.51 | 5 | 3 | 1 | 55 | 164.232 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.01 | 0.7 | -42.73 | 5 | 3 | 1 | 52 | 164.232 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
