In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2011 | 19 | Yes |
Popular Name: 2-[methyl-[2-(methylamino)ethyl]amino]-N-(2,3,4-trifluorophenyl)acetamide 2-[methyl-[2-(methylamino)ethyl]…
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) | 1.65 | 5.05 | -125.09 | 4 | 4 | 2 | 50 | 277.29 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.65 | 3.62 | -45.34 | 3 | 4 | 1 | 46 | 276.282 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.46 | 2.71 | -29.66 | 2 | 4 | 0 | 52 | 275.274 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.65 | 2.79 | -45.96 | 3 | 4 | 1 | 49 | 276.282 | 6 | ↓ |