| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 20 | 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) | 3.77 | 8.21 | -6.5 | 2 | 2 | 0 | 38 | 298.695 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.90 | 8.51 | -36.03 | 3 | 2 | 1 | 38 | 299.703 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
