| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 21 | 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) | 2.48 | 5.33 | -16.52 | 2 | 4 | 0 | 45 | 298.415 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.48 | 5.63 | -51.87 | 3 | 4 | 1 | 47 | 299.423 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
