In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | Yes |
Popular Name: 2-[[(2R)-2-cyanopropyl]-methyl-amino]pyridine-3-carboxamide 2-[[(2R)-2-cyanopropyl]-methyl-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) | 0.44 | 3.92 | -11.35 | 2 | 5 | 0 | 83 | 218.26 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.44 | 4.13 | -45.47 | 3 | 5 | 1 | 84 | 219.268 | 4 | ↓ |