In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2009 | 17 | No |
Popular Name: 2-[[2-(2-cyanoethylamino)-2-oxo-ethyl]-methyl-amino]-N-propyl-acetamide 2-[[2-(2-cyanoethylamino)-2-oxo-…
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) | -0.11 | 2.55 | -60.75 | 3 | 6 | 1 | 86 | 241.315 | 8 | ↓ |
Hi High (pH 8-9.5) | -0.11 | 0.29 | -29.04 | 2 | 6 | 0 | 85 | 240.307 | 8 | ↓ |