In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 16 | Yes |
Popular Name: N-(2-cyanoethyl)-2-[isopentyl(methyl)amino]-N-methyl-acetamide N-(2-cyanoethyl)-2-[isopentyl(me…
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) | 0.80 | 7.31 | -46.22 | 1 | 4 | 1 | 49 | 226.344 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.80 | 5.03 | -11.72 | 0 | 4 | 0 | 47 | 225.336 | 7 | ↓ |