| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 27 | 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) | 1.66 | -0.01 | -16.84 | 1 | 8 | 0 | 94 | 400.386 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 0.55 | -48.62 | 0 | 8 | -1 | 96 | 399.378 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
