In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 27 | No |
Popular Name: dioxo-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]BLAHcarboxamide dioxo-[2-oxo-2-(2,2,2-trifluoroe…
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) | -0.58 | 0.78 | -28.35 | 3 | 10 | 0 | 141 | 404.33 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.38 | -0.34 | -57.34 | 2 | 10 | -1 | 145 | 403.322 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.