| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2011 | 33 | 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) | 5.43 | 10.7 | -10.7 | 1 | 5 | 0 | 57 | 463.496 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.62 | 8.87 | -40.1 | 0 | 5 | -1 | 63 | 462.488 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
