| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 16th, 2007 | 31 | 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) | 3.81 | 10.54 | -20.64 | 1 | 6 | 0 | 79 | 449.454 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.62 | 9.64 | -52.44 | 0 | 6 | -1 | 86 | 448.446 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
