| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 18 | 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) | 1.80 | 4.34 | -53.88 | 2 | 6 | 1 | 85 | 246.246 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 2.64 | -8.81 | 1 | 6 | 0 | 80 | 245.238 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
