In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2011 | 18 | Yes |
Popular Name: 2-[2-cyanoethyl(2-methoxyethyl)amino]pyridine-3-carboxylic 2-[2-cyanoethyl(2-methoxyethyl)a…
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 | 6.93 | -40.08 | 1 | 6 | 0 | 91 | 249.27 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.11 | 6.43 | -42.85 | 0 | 6 | -1 | 89 | 248.262 | 7 | ↓ |