| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 10th, 2012 | 42 | 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) | 3.87 | 5.89 | -23.52 | 3 | 10 | 0 | 136 | 655.626 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.87 | 5.72 | -49.73 | 2 | 10 | -1 | 138 | 654.618 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.