| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 30th, 2008 | 30 | Yes |
| 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) | 3.70 | 9.07 | -78.64 | 3 | 5 | 2 | 42 | 419.654 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.70 | 6.99 | -32.19 | 2 | 5 | 1 | 40 | 418.646 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
