| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 18th, 2011 | 14 | 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) | 2.47 | 3.46 | -7.88 | 1 | 3 | 0 | 50 | 195.193 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.47 | 4.48 | -49.53 | 0 | 3 | -1 | 52 | 194.185 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
