In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2010 | 20 | No |
Popular Name: 2-[[2-(3-cyanoanilino)-2-oxo-ethyl]-ethyl-amino]-N-methyl-acetamide 2-[[2-(3-cyanoanilino)-2-oxo-eth…
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) | 1.23 | 4.35 | -49.97 | 3 | 6 | 1 | 86 | 275.332 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.23 | 2.36 | -20.72 | 2 | 6 | 0 | 85 | 274.324 | 6 | ↓ |