| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 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) | -0.70 | 1.03 | -59.63 | 2 | 5 | 1 | 64 | 223.3 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.70 | -0.37 | -12.9 | 1 | 5 | 0 | 59 | 222.292 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.70 | 3.19 | -133.87 | 3 | 5 | 2 | 65 | 224.308 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
