| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2008 | 28 | 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) | 2.46 | 7.78 | -15.05 | 1 | 7 | 0 | 89 | 397.456 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.28 | 6.23 | -48.22 | 0 | 7 | -1 | 95 | 396.448 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
