In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 29th, 2011 | 17 | Yes |
Popular Name: N-(2-cyanoethyl)-2-methyl-N-(3-pyridylmethyl)propanamide N-(2-cyanoethyl)-2-methyl-N-(3-p…
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) | 0.40 | 6.4 | -12.42 | 0 | 4 | 0 | 57 | 231.299 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.40 | 7.02 | -45.69 | 1 | 4 | 1 | 58 | 232.307 | 5 | ↓ |