In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2010 | 18 | Yes |
Popular Name: 2-[2-cyanoethyl(isobutyl)amino]pyridine-3-carboxylic 2-[2-cyanoethyl(isobutyl)amino]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) | 1.24 | 8.94 | -41.94 | 1 | 5 | 0 | 81 | 247.298 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.24 | 8.94 | -41.14 | 0 | 5 | -1 | 80 | 246.29 | 6 | ↓ |