| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2011 | 25 | 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) | 3.38 | 5.78 | -42.56 | 4 | 7 | 1 | 77 | 349.503 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.38 | 3.52 | -13.6 | 3 | 7 | 0 | 76 | 348.495 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
