In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: 5-amino-2-[[(2R)-2-cyanopropyl]-ethyl-amino]pyridine-3-carboxamide 5-amino-2-[[(2R)-2-cyanopropyl]-…
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) | 0.45 | 2.47 | -10.49 | 4 | 6 | 0 | 109 | 247.302 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.45 | 2.68 | -42.46 | 5 | 6 | 1 | 110 | 248.31 | 5 | ↓ |