| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 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) | 2.23 | 5.53 | -49.96 | 2 | 5 | 1 | 72 | 223.252 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.23 | 4.07 | -7.57 | 1 | 5 | 0 | 67 | 222.244 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
