| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2011 | 27 | 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) | 5.57 | 7.22 | -8.52 | 3 | 4 | 0 | 78 | 374.521 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.57 | 7.99 | -43.68 | 2 | 4 | -1 | 81 | 373.513 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
