In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2011 | 21 | Yes |
Popular Name: N-(3-pyrrol-1-ylphenyl)-2-(2,2,2-trifluoroethylamino)acetamide N-(3-pyrrol-1-ylphenyl)-2-(2,2,2…
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) | 2.29 | 6.93 | -56.05 | 3 | 4 | 1 | 51 | 298.288 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.29 | 5.6 | -12.65 | 2 | 4 | 0 | 46 | 297.28 | 6 | ↓ |