In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2009 | 28 | Yes |
Popular Name: N-(2-cyanoethyl)-2-[(2,4-difluorophenyl)methyl-methyl-amino]-N-(4-ethoxyphenyl)acetamide N-(2-cyanoethyl)-2-[(2,4-difluor…
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) | 2.94 | 12.11 | -58.42 | 1 | 5 | 1 | 58 | 388.438 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.94 | 9.74 | -16.59 | 0 | 5 | 0 | 57 | 387.43 | 9 | ↓ |