In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 15 | Yes |
Popular Name: 2-(2-dimethylaminoethylamino)-N-(2,2,2-trifluoroethyl)acetamide 2-(2-dimethylaminoethylamino)-N-…
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) | 0.31 | 1.2 | -39.18 | 3 | 4 | 1 | 46 | 228.238 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.31 | -1.28 | -6.27 | 2 | 4 | 0 | 44 | 227.23 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.31 | 0.09 | -43.52 | 3 | 4 | 1 | 49 | 228.238 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.31 | 2.55 | -115.66 | 4 | 4 | 2 | 50 | 229.246 | 7 | ↓ |