| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 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) | 0.87 | 4.37 | -38.37 | 2 | 4 | 1 | 56 | 223.296 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.87 | 3.11 | -6.56 | 1 | 4 | 0 | 51 | 222.288 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
