| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 20th, 2011 | 43 | 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) | 4.03 | 5.55 | -16.98 | 3 | 11 | 0 | 147 | 621.127 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.03 | 6.31 | -57.55 | 2 | 11 | -1 | 150 | 620.119 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
