| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2009 | 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) | 4.87 | 8.56 | -14.06 | 3 | 6 | 0 | 105 | 437.565 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.05 | 7.02 | -45.49 | 2 | 6 | -1 | 112 | 436.557 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
